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

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethyl)indol-4-yl]carbonylphosphonic acid Openeye Name: [3-(2-amino-2-oxo-ethyl)-1-benzyl-2-methyl-indole-4-carbonyl]phosphonic acid CAS Name: [[3-(2-amino-2-oxoethyl)-2-methyl-1-(phenylmethyl)-4-indolyl]-oxomethyl]phosphonic acid IUPAC Name: [3-(2-amino-2-oxoethyl)-1-benzyl-2-methylindole-4-carbonyl]phosphonic acid Traditional Name: [3-(2-amino-2-keto-ethyl)-1-benzyl-2-methyl-indole-4-carbonyl]phosphonic acid Formula: C19H19N2O5P MolecularWeight: 386.338321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2N1CC3=CC=CC=C3)C(=O)P(=O)(O)O)CC(=O)N

Isomeric SMILES

CC1=C(C2=C(C=CC=C2N1CC3=CC=CC=C3)C(=O)P(=O)(O)O)CC(=O)N

InChI

InChI=1S/C19H19N2O5P/c1-12-15(10-17(20)22)18-14(19(23)27(24,25)26)8-5-9-16(18)21(12)11-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3,(H2,20,22)(H2,24,25,26)