6-chloranyl-2-(3,4-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)chromen-4-imine

Systemtic Name: 6-chloranyl-2-(3,4-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)chromen-4-imine Openeye Name: 6-chloro-2-(3,4-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)chromen-4-imine CAS Name: 6-chloro-2-(3,4-dimethoxyphenyl)-N-[4-(1-pyrrolidinyl)phenyl]-1-benzopyran-4-imine IUPAC Name: 6-chloro-2-(3,4-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)chromen-4-imine Traditional Name: [6-chloro-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(4-pyrrolidinophenyl)amine Formula: C27H25ClN2O3 MolecularWeight: 460.952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC3=CC=C(C=C3)N4CCCC4)C5=C(O2)C=CC(=C5)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC3=CC=C(C=C3)N4CCCC4)C5=C(O2)C=CC(=C5)Cl)OC

InChI

InChI=1S/C27H25ClN2O3/c1-31-25-11-5-18(15-27(25)32-2)26-17-23(22-16-19(28)6-12-24(22)33-26)29-20-7-9-21(10-8-20)30-13-3-4-14-30/h5-12,15-17H,3-4,13-14H2,1-2H3