methyl 3-[4-(8-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[4-(8-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[4-(8-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-3-oxo-propanoate CAS Name: 3-[4-(8-methoxy-2-methyl-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(8-methoxy-2-methylbenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]-3-oxopropanoate Traditional Name: 3-keto-3-[4-(8-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]propionic acid methyl ester Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC(=O)OC)C2=NC3=C(C=C(C=C3)C)OC4=C2C=C(C=C4)OC

Isomeric SMILES

CC1CN(CCN1C(=O)CC(=O)OC)C2=NC3=C(C=C(C=C3)C)OC4=C2C=C(C=C4)OC

InChI

InChI=1S/C24H27N3O5/c1-15-5-7-19-21(11-15)32-20-8-6-17(30-3)12-18(20)24(25-19)26-9-10-27(16(2)14-26)22(28)13-23(29)31-4/h5-8,11-12,16H,9-10,13-14H2,1-4H3