(2S)-2-[[2-methylpropyl(2-phosphonoethyl)carbamoyl]amino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: (2S)-2-[[2-methylpropyl(2-phosphonoethyl)carbamoyl]amino]-3-naphthalen-2-yl-propanoic acid Openeye Name: (2S)-2-[[isobutyl(2-phosphonoethyl)carbamoyl]amino]-3-(2-naphthyl)propanoic acid CAS Name: (2S)-2-[[[2-methylpropyl(2-phosphonoethyl)amino]-oxomethyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: (2S)-2-[[2-methylpropyl(2-phosphonoethyl)carbamoyl]amino]-3-naphthalen-2-ylpropanoic acid Traditional Name: (2S)-2-[[isobutyl(2-phosphonoethyl)carbamoyl]amino]-3-(2-naphthyl)propionic acid Formula: C20H27N2O6P MolecularWeight: 422.411941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCP(=O)(O)O)C(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

CC(C)CN(CCP(=O)(O)O)C(=O)N[C@@H](CC1=CC2=CC=CC=C2C=C1)C(=O)O

InChI

InChI=1S/C20H27N2O6P/c1-14(2)13-22(9-10-29(26,27)28)20(25)21-18(19(23)24)12-15-7-8-16-5-3-4-6-17(16)11-15/h3-8,11,14,18H,9-10,12-13H2,1-2H3,(H,21,25)(H,23,24)(H2,26,27,28)/t18-/m0/s1