4-[4-(diphenylamino)-3-(phenylazanylmethyl)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol

Systemtic Name: 4-[4-(diphenylamino)-3-(phenylazanylmethyl)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol Openeye Name: 4-[3-(anilinomethyl)-4-(N-phenylanilino)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol CAS Name: 4-[3-(anilinomethyl)-4-(N-phenylanilino)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxyphenol IUPAC Name: 4-[3-(anilinomethyl)-4-(N-phenylanilino)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxyphenol Traditional Name: 4-[3-(anilinomethyl)-4-(N-phenylanilino)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol Formula: C35H31N3O3 MolecularWeight: 541.63894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(C(=NC3=CC=CC=C3O2)N(C4=CC=CC=C4)C5=CC=CC=C5)CNC6=CC=CC=C6)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(=NC3=CC=CC=C3O2)N(C4=CC=CC=C4)C5=CC=CC=C5)CNC6=CC=CC=C6)O

InChI

InChI=1S/C35H31N3O3/c1-40-33-23-25(21-22-31(33)39)34-29(24-36-26-13-5-2-6-14-26)35(37-30-19-11-12-20-32(30)41-34)38(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-23,29,34,36,39H,24H2,1H3