2-[3-(2-azanyl-2-oxidanylidene-ethyl)-1-(phenylmethyl)indol-4-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[3-(2-azanyl-2-oxidanylidene-ethyl)-1-(phenylmethyl)indol-4-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3-(2-amino-2-oxo-ethyl)-1-benzyl-indol-4-yl]-2-oxo-acetic acid CAS Name: 2-[3-(2-amino-2-oxoethyl)-1-(phenylmethyl)-4-indolyl]-2-oxoacetic acid IUPAC Name: 2-[3-(2-amino-2-oxoethyl)-1-benzylindol-4-yl]-2-oxoacetic acid Traditional Name: 2-[3-(2-amino-2-keto-ethyl)-1-benzyl-indol-4-yl]-2-keto-acetic acid Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=C(C=CC=C32)C(=O)C(=O)O)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=C(C=CC=C32)C(=O)C(=O)O)CC(=O)N

InChI

InChI=1S/C19H16N2O4/c20-16(22)9-13-11-21(10-12-5-2-1-3-6-12)15-8-4-7-14(17(13)15)18(23)19(24)25/h1-8,11H,9-10H2,(H2,20,22)(H,24,25)