methyl 4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-keto-1-methyl-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid methyl ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2CC(C(C1=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C2=CC=CC=C2CC(C(C1=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19NO5/c1-21-15-6-4-3-5-13(15)9-14(18(19(21)22)20(23)24-2)12-7-8-16-17(10-12)26-11-25-16/h3-8,10,14,18H,9,11H2,1-2H3