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

Systemtic Name: 5-azanyl-2-[3-(6-carbamimidoyl-4-methyl-4-phenyl-2,3-dihydro-1H-quinolin-2-yl)phenyl]benzoic acid Openeye Name: 5-amino-2-[3-(6-carbamimidoyl-4-methyl-4-phenyl-2,3-dihydro-1H-quinolin-2-yl)phenyl]benzoic acid CAS Name: 5-amino-2-[3-(6-carbamimidoyl-4-methyl-4-phenyl-2,3-dihydro-1H-quinolin-2-yl)phenyl]benzoic acid IUPAC Name: 5-amino-2-[3-(6-carbamimidoyl-4-methyl-4-phenyl-2,3-dihydro-1H-quinolin-2-yl)phenyl]benzoic acid Traditional Name: 2-[3-(6-amidino-4-methyl-4-phenyl-2,3-dihydro-1H-quinolin-2-yl)phenyl]-5-amino-benzoic acid Formula: C30H28N4O2 MolecularWeight: 476.56892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(NC2=C1C=C(C=C2)C(=N)N)C3=CC=CC(=C3)C4=C(C=C(C=C4)N)C(=O)O)C5=CC=CC=C5

Isomeric SMILES

CC1(CC(NC2=C1C=C(C=C2)C(=N)N)C3=CC=CC(=C3)C4=C(C=C(C=C4)N)C(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C30H28N4O2/c1-30(21-8-3-2-4-9-21)17-27(34-26-13-10-20(28(32)33)15-25(26)30)19-7-5-6-18(14-19)23-12-11-22(31)16-24(23)29(35)36/h2-16,27,34H,17,31H2,1H3,(H3,32,33)(H,35,36)