N-[3-[2-(4-carbamimidoylphenyl)propanoyl]-1,2,3,4-tetrahydroquinolin-6-yl]-N-methyl-benzamide

Systemtic Name: N-[3-[2-(4-carbamimidoylphenyl)propanoyl]-1,2,3,4-tetrahydroquinolin-6-yl]-N-methyl-benzamide Openeye Name: N-[3-[2-(4-carbamimidoylphenyl)propanoyl]-1,2,3,4-tetrahydroquinolin-6-yl]-N-methyl-benzamide CAS Name: N-[3-[2-(4-carbamimidoylphenyl)-1-oxopropyl]-1,2,3,4-tetrahydroquinolin-6-yl]-N-methylbenzamide IUPAC Name: N-[3-[2-(4-carbamimidoylphenyl)propanoyl]-1,2,3,4-tetrahydroquinolin-6-yl]-N-methylbenzamide Traditional Name: N-[3-[2-(4-amidinophenyl)propanoyl]-1,2,3,4-tetrahydroquinolin-6-yl]-N-methyl-benzamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=N)N)C(=O)C2CC3=C(C=CC(=C3)N(C)C(=O)C4=CC=CC=C4)NC2

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=N)N)C(=O)C2CC3=C(C=CC(=C3)N(C)C(=O)C4=CC=CC=C4)NC2

InChI

InChI=1S/C27H28N4O2/c1-17(18-8-10-19(11-9-18)26(28)29)25(32)22-14-21-15-23(12-13-24(21)30-16-22)31(2)27(33)20-6-4-3-5-7-20/h3-13,15,17,22,30H,14,16H2,1-2H3,(H3,28,29)