2-[2-[(6-carbamimidoyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[(6-carbamimidoyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[2-[(6-carbamimidoyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[2-[(6-carbamimidoyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(6-carbamimidoyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[2-[(6-amidino-3,4-dihydro-2H-quinolin-1-yl)methyl]phenyl]benzoic acid Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(=N)N)N(C1)CC3=CC=CC=C3C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(=N)N)N(C1)CC3=CC=CC=C3C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C24H23N3O2/c25-23(26)17-11-12-22-16(14-17)7-5-13-27(22)15-18-6-1-2-8-19(18)20-9-3-4-10-21(20)24(28)29/h1-4,6,8-12,14H,5,7,13,15H2,(H3,25,26)(H,28,29)