methyl 1-[2-[1-(1H-benzimidazol-2-yl)ethylamino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[1-(1H-benzimidazol-2-yl)ethylamino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[1-(1H-benzimidazol-2-yl)ethylamino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[1-(1H-benzimidazol-2-yl)ethylamino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[1-(1H-benzimidazol-2-yl)ethylamino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-[1-(1H-benzimidazol-2-yl)ethylamino]-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)NC(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CC(C1=NC2=CC=CC=C2N1)NC(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C21H20N4O3/c1-13(20-23-16-8-4-5-9-17(16)24-20)22-19(26)12-25-11-15(21(27)28-2)14-7-3-6-10-18(14)25/h3-11,13H,12H2,1-2H3,(H,22,26)(H,23,24)