5-azanyl-2-[[1-(carboxymethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]pentanoic acid hydrochloride

Systemtic Name: 5-azanyl-2-[[1-(carboxymethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]pentanoic acid hydrochloride Openeye Name: 5-amino-2-[[1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]pentanoic acid hydrochloride CAS Name: 5-amino-2-[[1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]pentanoic acid hydrochloride IUPAC Name: 5-amino-2-[[1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]pentanoic acid hydrochloride Traditional Name: 5-amino-2-[[1-(carboxymethyl)-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]amino]valeric acid hydrochloride Formula: C17H24ClN3O5 MolecularWeight: 385.84256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1NC(CCCN)C(=O)O)CC(=O)O.Cl

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1NC(CCCN)C(=O)O)CC(=O)O.Cl

InChI

InChI=1S/C17H23N3O5.ClH/c18-9-3-5-13(17(24)25)19-12-8-7-11-4-1-2-6-14(11)20(16(12)23)10-15(21)22;/h1-2,4,6,12-13,19H,3,5,7-10,18H2,(H,21,22)(H,24,25);1H