2-phenyl-4-[(2,3,4-trimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 2-phenyl-4-[(2,3,4-trimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 2-phenyl-4-[(2,3,4-trimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 2-phenyl-4-[(2,3,4-trimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 2-phenyl-4-[(2,3,4-trimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 2-phenyl-4-(2,3,4-trimethoxybenzyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CC(OC3=CC=CC=C3C2)C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CC(OC3=CC=CC=C3C2)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H27NO4/c1-27-22-14-13-20(24(28-2)25(22)29-3)16-26-15-19-11-7-8-12-21(19)30-23(17-26)18-9-5-4-6-10-18/h4-14,23H,15-17H2,1-3H3