ethyl 10-methoxy-5-(2-methoxyphenyl)carbonyl-6H-benzo[b][1,4]benzoxazepine-3-carboxylate

Systemtic Name: ethyl 10-methoxy-5-(2-methoxyphenyl)carbonyl-6H-benzo[b][1,4]benzoxazepine-3-carboxylate Openeye Name: ethyl 10-methoxy-5-(2-methoxybenzoyl)-6H-benzo[b][1,4]benzoxazepine-3-carboxylate CAS Name: 10-methoxy-5-[(2-methoxyphenyl)-oxomethyl]-6H-benzo[b][1,4]benzoxazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 10-methoxy-5-(2-methoxybenzoyl)-6H-benzo[b][1,4]benzoxazepine-3-carboxylate Traditional Name: 10-methoxy-5-o-anisoyl-6H-benzo[b][1,4]benzoxazepine-3-carboxylic acid ethyl ester Formula: C25H23NO6 MolecularWeight: 433.45322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC3=C(CN2C(=O)C4=CC=CC=C4OC)C=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC3=C(CN2C(=O)C4=CC=CC=C4OC)C=CC=C3OC

InChI

InChI=1S/C25H23NO6/c1-4-31-25(28)16-12-13-21-19(14-16)26(24(27)18-9-5-6-10-20(18)29-2)15-17-8-7-11-22(30-3)23(17)32-21/h5-14H,4,15H2,1-3H3