diethyl 2-acetamido-2-[(6-chloranyl-1H-indol-3-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(6-chloranyl-1H-indol-3-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(6-chloro-1H-indol-3-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(6-chloro-1H-indol-3-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(6-chloro-1H-indol-3-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(6-chloro-1H-indol-3-yl)methyl]malonic acid diethyl ester Formula: C18H21ClN2O5 MolecularWeight: 380.82274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=CC(=C2)Cl)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CNC2=C1C=CC(=C2)Cl)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H21ClN2O5/c1-4-25-16(23)18(21-11(3)22,17(24)26-5-2)9-12-10-20-15-8-13(19)6-7-14(12)15/h6-8,10,20H,4-5,9H2,1-3H3,(H,21,22)