methyl (2R)-2-[(3-fluoranyl-4-methyl-5-nitro-phenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[(3-fluoranyl-4-methyl-5-nitro-phenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[(3-fluoro-4-methyl-5-nitro-benzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[(3-fluoro-4-methyl-5-nitrophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-fluoro-4-methyl-5-nitrobenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[(3-fluoro-4-methyl-5-nitro-benzoyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C20H18FN3O5 MolecularWeight: 399.372423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1F)C(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN3O5/c1-11-15(21)7-12(9-18(11)24(27)28)19(25)23-17(20(26)29-2)8-13-10-22-16-6-4-3-5-14(13)16/h3-7,9-10,17,22H,8H2,1-2H3,(H,23,25)/t17-/m1/s1