(4E)-2-(azepan-1-ylmethyl)-4-(2-methyl-1H-quinolin-4-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-(azepan-1-ylmethyl)-4-(2-methyl-1H-quinolin-4-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-(azepan-1-ylmethyl)-4-(2-methyl-1H-quinolin-4-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-(1-azepanylmethyl)-4-(2-methyl-1H-quinolin-4-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-(azepan-1-ylmethyl)-4-(2-methyl-1H-quinolin-4-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-(azepan-1-ylmethyl)-4-(2-methyl-1H-quinolin-4-ylidene)cyclohexa-2,5-dien-1-one Formula: C23H26N2O MolecularWeight: 346.46534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC(=O)C(=C2)CN3CCCCCC3)C4=CC=CC=C4N1

Isomeric SMILES

CC1=C/C(=C\2/C=CC(=O)C(=C2)CN3CCCCCC3)/C4=CC=CC=C4N1

InChI

InChI=1S/C23H26N2O/c1-17-14-21(20-8-4-5-9-22(20)24-17)18-10-11-23(26)19(15-18)16-25-12-6-2-3-7-13-25/h4-5,8-11,14-15,24H,2-3,6-7,12-13,16H2,1H3/b21-18+