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

Systemtic Name: 1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-N-(phenylmethyl)-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-benzyl-1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-[3-(4-carbamimidoylphenyl)-1-oxopropyl]-N-phenyl-N-(phenylmethyl)-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-benzyl-1-[3-(4-carbamimidoylphenyl)propanoyl]-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-[3-(4-amidinophenyl)propanoyl]-N-benzyl-N-phenyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C33H32N4O2 MolecularWeight: 516.63278

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4)N(C1)C(=O)CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4)N(C1)C(=O)CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C33H32N4O2/c34-32(35)26-16-13-24(14-17-26)15-20-31(38)36-21-7-10-27-22-28(18-19-30(27)36)33(39)37(29-11-5-2-6-12-29)23-25-8-3-1-4-9-25/h1-6,8-9,11-14,16-19,22H,7,10,15,20-21,23H2,(H3,34,35)