methyl 1-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-[cyclopropyl-(2-fluorobenzyl)amino]-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N(CC3=CC=CC=C3F)C4CC4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N(CC3=CC=CC=C3F)C4CC4

InChI

InChI=1S/C22H21FN2O3/c1-28-22(27)18-13-24(20-9-5-3-7-17(18)20)14-21(26)25(16-10-11-16)12-15-6-2-4-8-19(15)23/h2-9,13,16H,10-12,14H2,1H3