methyl 3-[3-(methylamino)propanoylamino]-5,6-dihydrobenzo[b][1]benzazepine-11-carboxylate

Systemtic Name: methyl 3-[3-(methylamino)propanoylamino]-5,6-dihydrobenzo[b][1]benzazepine-11-carboxylate Openeye Name: methyl 3-[3-(methylamino)propanoylamino]-5,6-dihydrobenzo[b][1]benzazepine-11-carboxylate CAS Name: 3-[[3-(methylamino)-1-oxopropyl]amino]-5,6-dihydrobenzo[b][1]benzazepine-11-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-(methylamino)propanoylamino]-5,6-dihydrobenzo[b][1]benzazepine-11-carboxylate Traditional Name: 3-[3-(methylamino)propanoylamino]-5,6-dihydrobenzo[b][1]benzazepine-11-carboxylic acid methyl ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C3CC2)C(=O)OC

Isomeric SMILES

CNCCC(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C3CC2)C(=O)OC

InChI

InChI=1S/C20H23N3O3/c1-21-12-11-19(24)22-16-9-10-18-15(13-16)8-7-14-5-3-4-6-17(14)23(18)20(25)26-2/h3-6,9-10,13,21H,7-8,11-12H2,1-2H3,(H,22,24)