methyl (2R)-2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H21ClN2O4/c1-13-9-15(22)7-8-19(13)28-12-20(25)24-18(21(26)27-2)10-14-11-23-17-6-4-3-5-16(14)17/h3-9,11,18,23H,10,12H2,1-2H3,(H,24,25)/t18-/m1/s1