6-azanyl-2-[(6-oxidanylidene-5H-phenanthridin-3-yl)carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[(6-oxidanylidene-5H-phenanthridin-3-yl)carbonylamino]hexanoic acid Openeye Name: 6-amino-2-[(6-oxo-5H-phenanthridine-3-carbonyl)amino]hexanoic acid CAS Name: 6-amino-2-[[oxo-(6-oxo-5H-phenanthridin-3-yl)methyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[(6-oxo-5H-phenanthridine-3-carbonyl)amino]hexanoic acid Traditional Name: 6-amino-2-[(6-keto-5H-phenanthridine-3-carbonyl)amino]hexanoic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=C(C=C3)C(=O)NC(CCCCN)C(=O)O)NC2=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=C(C=C3)C(=O)NC(CCCCN)C(=O)O)NC2=O

InChI

InChI=1S/C20H21N3O4/c21-10-4-3-7-16(20(26)27)22-18(24)12-8-9-14-13-5-1-2-6-15(13)19(25)23-17(14)11-12/h1-2,5-6,8-9,11,16H,3-4,7,10,21H2,(H,22,24)(H,23,25)(H,26,27)