[(4-carbamimidoylphenyl)amino]-[3-(2-carboxyethylamino)-3-oxidanylidene-propyl]imino-ethanoyl-azanium

Systemtic Name: [(4-carbamimidoylphenyl)amino]-[3-(2-carboxyethylamino)-3-oxidanylidene-propyl]imino-ethanoyl-azanium Openeye Name: acetyl-(4-carbamimidoylanilino)-[3-(2-carboxyethylamino)-3-oxo-propyl]imino-ammonium CAS Name: acetyl-(4-carbamimidoylanilino)-[3-(2-carboxyethylamino)-3-oxopropyl]iminoammonium IUPAC Name: acetyl-(4-carbamimidoylanilino)-[3-(2-carboxyethylamino)-3-oxopropyl]iminoazanium Traditional Name: acetyl-(4-amidinoanilino)-[3-(2-carboxyethylamino)-3-keto-propyl]imino-ammonium Formula: C15H21N6O4+ MolecularWeight: 349.36504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+](=NCCC(=O)NCCC(=O)O)NC1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CC(=O)[N+](=NCCC(=O)NCCC(=O)O)NC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C15H20N6O4/c1-10(22)21(19-9-6-13(23)18-8-7-14(24)25)20-12-4-2-11(3-5-12)15(16)17/h2-5H,6-9H2,1H3,(H5-,16,17,18,19,20,23,24,25)/p+1