2-[2-(5-piperidin-2-ylpentylcarbamoyl)-1,3,4,5-tetrahydro-2-benzazepin-5-yl]ethanoic acid

Systemtic Name: 2-[2-(5-piperidin-2-ylpentylcarbamoyl)-1,3,4,5-tetrahydro-2-benzazepin-5-yl]ethanoic acid Openeye Name: 2-[2-[5-(2-piperidyl)pentylcarbamoyl]-1,3,4,5-tetrahydro-2-benzazepin-5-yl]acetic acid CAS Name: 2-[2-[oxo-[5-(2-piperidinyl)pentylamino]methyl]-1,3,4,5-tetrahydro-2-benzazepin-5-yl]acetic acid IUPAC Name: 2-[2-(5-piperidin-2-ylpentylcarbamoyl)-1,3,4,5-tetrahydro-2-benzazepin-5-yl]acetic acid Traditional Name: 2-[2-[5-(2-piperidyl)pentylcarbamoyl]-1,3,4,5-tetrahydro-2-benzazepin-5-yl]acetic acid Formula: C23H35N3O3 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)CCCCCNC(=O)N2CCC(C3=CC=CC=C3C2)CC(=O)O

Isomeric SMILES

C1CCNC(C1)CCCCCNC(=O)N2CCC(C3=CC=CC=C3C2)CC(=O)O

InChI

InChI=1S/C23H35N3O3/c27-22(28)16-18-12-15-26(17-19-8-3-4-11-21(18)19)23(29)25-14-6-1-2-9-20-10-5-7-13-24-20/h3-4,8,11,18,20,24H,1-2,5-7,9-10,12-17H2,(H,25,29)(H,27,28)