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4-Methoxy-6-[[[2-[(3-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,2-diphenylethenyl]amino]methylidene]cyclohexa-2,4-dien-1-one;oxovanadium

HCID 6850486
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Basic information

CAS
7238-54-2
Standard SMILES
COC1=CC(=CNC(=C(NC=C2C=C(OC)C=CC2=O)c2ccccc2)c2ccccc2)C(=O)C=C1.[O]=[V]
InChIKey
APDLJFBIAYXKKX-UHFFFAOYSA-N
Molecular formula
C30H26N2O5V
Average molar mass
545.5 g/mol
Monoisotopic mass
545.12813

Names & identifiers

Preferred name
4-Methoxy-6-[[[2-[(3-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,2-diphenylethenyl]amino]methylidene]cyclohexa-2,4-dien-1-one;oxovanadium
IUPAC
4-methoxy-6-[[[2-[(3-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,2-diphenylethenyl]amino]methylidene]cyclohexa-2,4-dien-1-one;oxovanadium

Database identifiers

CAS
7238-54-2
PubChem CID
6850486
DTXSID
DTXSID70425847

Properties

Computed structural properties

Topological polar surface area
93.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
38
Formal charge
0
Complexity
1,000

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