4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]-9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]-9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]-9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(2,4-dimethoxy-3-methylphenyl)methyl]-9-methoxy-7-(3-quinolinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(2,4-dimethoxy-3-methylphenyl)methyl]-9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(2,4-dimethoxy-3-methyl-benzyl)-9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C29H30N2O4 MolecularWeight: 470.5595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)CN2CCOC3=C(C2)C=C(C=C3OC)C4=CC5=CC=CC=C5N=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)CN2CCOC3=C(C2)C=C(C=C3OC)C4=CC5=CC=CC=C5N=C4)OC

InChI

InChI=1S/C29H30N2O4/c1-19-26(32-2)10-9-21(28(19)34-4)17-31-11-12-35-29-24(18-31)14-22(15-27(29)33-3)23-13-20-7-5-6-8-25(20)30-16-23/h5-10,13-16H,11-12,17-18H2,1-4H3