methyl 3-(1H-indol-3-yl)-2-(3-oxidanylidenebutanoylamino)propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-(3-oxidanylidenebutanoylamino)propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-(3-oxobutanoylamino)propanoate CAS Name: 2-(1,3-dioxobutylamino)-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-(3-oxobutanoylamino)propanoate Traditional Name: 2-(acetoacetylamino)-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC

Isomeric SMILES

CC(=O)CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC

InChI

InChI=1S/C16H18N2O4/c1-10(19)7-15(20)18-14(16(21)22-2)8-11-9-17-13-6-4-3-5-12(11)13/h3-6,9,14,17H,7-8H2,1-2H3,(H,18,20)