methyl 5-methyl-4-oxidanylidene-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate

Systemtic Name: methyl 5-methyl-4-oxidanylidene-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate Openeye Name: methyl 5-methyl-4-oxo-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate CAS Name: 5-methyl-4-oxo-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-oxo-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate Traditional Name: 4-keto-5-methyl-1,2,3,6-tetrahydroazepin[4,5-b]indole-5-carboxylic acid methyl ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(CCNC1=O)C3=CC=CC=C3N2)C(=O)OC

Isomeric SMILES

CC1(C2=C(CCNC1=O)C3=CC=CC=C3N2)C(=O)OC

InChI

InChI=1S/C15H16N2O3/c1-15(14(19)20-2)12-10(7-8-16-13(15)18)9-5-3-4-6-11(9)17-12/h3-6,17H,7-8H2,1-2H3,(H,16,18)