methyl 2-(3H-benzimidazol-5-ylcarbonylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-(3H-benzimidazol-5-ylcarbonylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-(3H-benzimidazole-5-carbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[3H-benzimidazol-5-yl(oxo)methyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-(3H-benzimidazole-5-carbonylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: 2-(3H-benzimidazole-5-carbonylamino)-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C20H18N4O3/c1-27-20(26)18(9-13-10-21-15-5-3-2-4-14(13)15)24-19(25)12-6-7-16-17(8-12)23-11-22-16/h2-8,10-11,18,21H,9H2,1H3,(H,22,23)(H,24,25)