(2R)-2-[(3-carbamimidoylphenyl)carbonylamino]-3-(1H-indol-2-yl)propanoic acid

Systemtic Name: (2R)-2-[(3-carbamimidoylphenyl)carbonylamino]-3-(1H-indol-2-yl)propanoic acid Openeye Name: (2R)-2-[(3-carbamimidoylbenzoyl)amino]-3-(1H-indol-2-yl)propanoic acid CAS Name: (2R)-2-[[(3-carbamimidoylphenyl)-oxomethyl]amino]-3-(1H-indol-2-yl)propanoic acid IUPAC Name: (2R)-2-[(3-carbamimidoylbenzoyl)amino]-3-(1H-indol-2-yl)propanoic acid Traditional Name: (2R)-2-[(3-amidinobenzoyl)amino]-3-(1H-indol-2-yl)propionic acid Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2)CC(C(=O)O)NC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)C[C@H](C(=O)O)NC(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C19H18N4O3/c20-17(21)12-5-3-6-13(8-12)18(24)23-16(19(25)26)10-14-9-11-4-1-2-7-15(11)22-14/h1-9,16,22H,10H2,(H3,20,21)(H,23,24)(H,25,26)/t16-/m1/s1