3-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propylamino]benzoic acid

Systemtic Name: 3-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propylamino]benzoic acid Openeye Name: 3-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propylamino]benzoic acid CAS Name: 3-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propylamino]benzoic acid IUPAC Name: 3-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propylamino]benzoic acid Traditional Name: 3-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propylamino]benzoic acid Formula: C24H24N2O2 MolecularWeight: 372.45956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C3=CC=CC=C31)CCCNC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C3=CC=CC=C31)CCCNC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C24H24N2O2/c27-24(28)20-9-5-10-21(17-20)25-15-6-16-26-22-11-3-1-7-18(22)13-14-19-8-2-4-12-23(19)26/h1-5,7-12,17,25H,6,13-16H2,(H,27,28)