3-chloranyl-N-[[(4Z)-4-indol-3-ylidene-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]methyl]aniline

Systemtic Name: 3-chloranyl-N-[[(4Z)-4-indol-3-ylidene-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]methyl]aniline Openeye Name: 3-chloro-N-[[(4Z)-4-indol-3-ylidene-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]methyl]aniline CAS Name: 3-chloro-N-[[(4Z)-4-(3-indolylidene)-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]methyl]aniline IUPAC Name: 3-chloro-N-[[(4Z)-4-indol-3-ylidene-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]methyl]aniline Traditional Name: (3-chlorophenyl)-[[(4Z)-4-indol-3-ylidene-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]methyl]amine Formula: C31H26ClN3O2 MolecularWeight: 508.01004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=C3C=NC4=CC=CC=C43)NC5=CC=CC=C5O2)CNC6=CC(=CC=C6)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2C(/C(=C\3/C=NC4=CC=CC=C43)/NC5=CC=CC=C5O2)CNC6=CC(=CC=C6)Cl

InChI

InChI=1S/C31H26ClN3O2/c1-36-23-15-13-20(14-16-23)31-26(19-33-22-8-6-7-21(32)17-22)30(35-28-11-4-5-12-29(28)37-31)25-18-34-27-10-3-2-9-24(25)27/h2-18,26,31,33,35H,19H2,1H3/b30-25+