methyl 2-[(2-chloranyl-2-oxidanylidene-ethanoyl)-[2-ethyl-1-(phenylmethyl)indol-4-yl]amino]ethanoate

Systemtic Name: methyl 2-[(2-chloranyl-2-oxidanylidene-ethanoyl)-[2-ethyl-1-(phenylmethyl)indol-4-yl]amino]ethanoate Openeye Name: methyl 2-[(1-benzyl-2-ethyl-indol-4-yl)-(2-chloro-2-oxo-acetyl)amino]acetate CAS Name: 2-[(2-chloro-1,2-dioxoethyl)-[2-ethyl-1-(phenylmethyl)-4-indolyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(1-benzyl-2-ethylindol-4-yl)-(2-chloro-2-oxoacetyl)amino]acetate Traditional Name: 2-[(1-benzyl-2-ethyl-indol-4-yl)-(2-chloro-2-keto-acetyl)amino]acetic acid methyl ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N1CC3=CC=CC=C3)C=CC=C2N(CC(=O)OC)C(=O)C(=O)Cl

Isomeric SMILES

CCC1=CC2=C(N1CC3=CC=CC=C3)C=CC=C2N(CC(=O)OC)C(=O)C(=O)Cl

InChI

InChI=1S/C22H21ClN2O4/c1-3-16-12-17-18(24(16)13-15-8-5-4-6-9-15)10-7-11-19(17)25(14-20(26)29-2)22(28)21(23)27/h4-12H,3,13-14H2,1-2H3