[7H-benzo[d][1,3]benzodiazepin-6-yl-(4-methoxyphenyl)amino]-triphenyl-phosphanium

Systemtic Name: [7H-benzo[d][1,3]benzodiazepin-6-yl-(4-methoxyphenyl)amino]-triphenyl-phosphanium Openeye Name: [N-(7H-benzo[d][1,3]benzodiazepin-6-yl)-4-methoxy-anilino]-triphenyl-phosphonium CAS Name: [N-(7H-benzo[d][1,3]benzodiazepin-6-yl)-4-methoxyanilino]-triphenylphosphonium IUPAC Name: [N-(7H-benzo[d][1,3]benzodiazepin-6-yl)-4-methoxyanilino]-triphenylphosphanium Traditional Name: [N-(7H-benzo[d][1,3]benzodiazepin-6-yl)-4-methoxy-anilino]-triphenyl-phosphonium Formula: C38H31N3OP+ MolecularWeight: 576.646001

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3C4=CC=CC=C4N2)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

COC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3C4=CC=CC=C4N2)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C38H31N3OP/c1-42-30-27-25-29(26-28-30)41(38-39-36-23-13-11-21-34(36)35-22-12-14-24-37(35)40-38)43(31-15-5-2-6-16-31,32-17-7-3-8-18-32)33-19-9-4-10-20-33/h2-28H,1H3,(H,39,40)/q+1