methyl (2R)-2-[(3-carbamimidoylphenyl)carbonylamino]-3-(1H-indol-2-yl)propanoate

Systemtic Name: methyl (2R)-2-[(3-carbamimidoylphenyl)carbonylamino]-3-(1H-indol-2-yl)propanoate Openeye Name: methyl (2R)-2-[(3-carbamimidoylbenzoyl)amino]-3-(1H-indol-2-yl)propanoate CAS Name: (2R)-2-[[(3-carbamimidoylphenyl)-oxomethyl]amino]-3-(1H-indol-2-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-carbamimidoylbenzoyl)amino]-3-(1H-indol-2-yl)propanoate Traditional Name: (2R)-2-[(3-amidinobenzoyl)amino]-3-(1H-indol-2-yl)propionic acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC2=CC=CC=C2N1)NC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

COC(=O)[C@@H](CC1=CC2=CC=CC=C2N1)NC(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C20H20N4O3/c1-27-20(26)17(11-15-10-12-5-2-3-8-16(12)23-15)24-19(25)14-7-4-6-13(9-14)18(21)22/h2-10,17,23H,11H2,1H3,(H3,21,22)(H,24,25)/t17-/m1/s1