4-[(1,2-dimethylindol-5-yl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(1,2-dimethylindol-5-yl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(1,2-dimethylindol-5-yl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(1,2-dimethyl-5-indolyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(1,2-dimethylindol-5-yl)methylamino]-4-oxobutanoic acid Traditional Name: 4-[(1,2-dimethylindol-5-yl)methylamino]-4-keto-butyric acid Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C)C=CC(=C2)CNC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC2=C(N1C)C=CC(=C2)CNC(=O)CCC(=O)O

InChI

InChI=1S/C15H18N2O3/c1-10-7-12-8-11(3-4-13(12)17(10)2)9-16-14(18)5-6-15(19)20/h3-4,7-8H,5-6,9H2,1-2H3,(H,16,18)(H,19,20)