2-(3,4-dimethoxyphenyl)-5-[methyl-[2-[(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)methoxy]ethyl]amino]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[methyl-[2-[(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)methoxy]ethyl]amino]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[methyl-[2-[(3-methyl-4-oxo-2-phenyl-chromen-8-yl)methoxy]ethyl]amino]pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[methyl-[2-[(3-methyl-4-oxo-2-phenyl-1-benzopyran-8-yl)methoxy]ethyl]amino]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[methyl-[2-[(3-methyl-4-oxo-2-phenylchromen-8-yl)methoxy]ethyl]amino]-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-[(4-keto-3-methyl-2-phenyl-chromen-8-yl)methoxy]ethyl-methyl-amino]valeronitrile Formula: C36H42N2O5 MolecularWeight: 582.72908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2COCCN(C)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2COCCN(C)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C4=CC=CC=C4

InChI

InChI=1S/C36H42N2O5/c1-25(2)36(24-37,29-16-17-31(40-5)32(22-29)41-6)18-11-19-38(4)20-21-42-23-28-14-10-15-30-33(39)26(3)34(43-35(28)30)27-12-8-7-9-13-27/h7-10,12-17,22,25H,11,18-21,23H2,1-6H3