2-[(4-methoxyphenyl)amino]-3-(4-methylphenyl)-4-[(triphenyl-$l^{5}-phosphanylidene)amino]-1-benzazepin-5-one

Systemtic Name: 2-[(4-methoxyphenyl)amino]-3-(4-methylphenyl)-4-[(triphenyl-$l^{5}-phosphanylidene)amino]-1-benzazepin-5-one Openeye Name: 2-(4-methoxyanilino)-3-(p-tolyl)-4-[(triphenyl-$l^{5}-phosphanylidene)amino]-1-benzazepin-5-one CAS Name: 2-(4-methoxyanilino)-3-(4-methylphenyl)-4-(triphenylphosphoranylideneamino)-1-benzazepin-5-one IUPAC Name: 2-(4-methoxyanilino)-3-(4-methylphenyl)-4-[(triphenyl-$l^{5}-phosphanylidene)amino]-1-benzazepin-5-one Traditional Name: 2-(p-anisidino)-3-(p-tolyl)-4-(triphenylphosphoranylideneamino)-1-benzazepin-5-one Formula: C42H34N3O2P MolecularWeight: 643.712021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3N=C2NC4=CC=C(C=C4)OC)N=P(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3N=C2NC4=CC=C(C=C4)OC)N=P(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C42H34N3O2P/c1-30-22-24-31(25-23-30)39-40(41(46)37-20-12-13-21-38(37)44-42(39)43-32-26-28-33(47-2)29-27-32)45-48(34-14-6-3-7-15-34,35-16-8-4-9-17-35)36-18-10-5-11-19-36/h3-29H,1-2H3,(H,43,44)