N-butyl-1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide hydrochloride

Systemtic Name: N-butyl-1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide hydrochloride Openeye Name: N-butyl-1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide hydrochloride CAS Name: N-butyl-1-[3-(4-carbamimidoylphenyl)-1-oxopropyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide hydrochloride IUPAC Name: N-butyl-1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide hydrochloride Traditional Name: 1-[3-(4-amidinophenyl)propanoyl]-N-butyl-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide hydrochloride Formula: C30H35ClN4O2 MolecularWeight: 519.0775

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CCC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CCC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C30H34N4O2.ClH/c1-2-3-19-33(26-9-5-4-6-10-26)30(36)25-16-17-27-24(21-25)8-7-20-34(27)28(35)18-13-22-11-14-23(15-12-22)29(31)32;/h4-6,9-12,14-17,21H,2-3,7-8,13,18-20H2,1H3,(H3,31,32);1H