[1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-oxidanylidene-butan-2-yl] 3-azanylbenzoate

Systemtic Name: [1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-oxidanylidene-butan-2-yl] 3-azanylbenzoate Openeye Name: 1-(5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl)propyl 3-aminobenzoate CAS Name: 3-aminobenzoic acid [1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-oxobutan-2-yl] ester IUPAC Name: [1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-oxobutan-2-yl] 3-aminobenzoate Traditional Name: 3-aminobenzoic acid 1-(5,6-dihydrobenzo[b][1]benzazepine-11-carbonyl)propyl ester Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2CCC3=CC=CC=C31)OC(=O)C4=CC(=CC=C4)N

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2CCC3=CC=CC=C31)OC(=O)C4=CC(=CC=C4)N

InChI

InChI=1S/C25H24N2O3/c1-2-23(30-25(29)19-10-7-11-20(26)16-19)24(28)27-21-12-5-3-8-17(21)14-15-18-9-4-6-13-22(18)27/h3-13,16,23H,2,14-15,26H2,1H3