(2S)-2-[[2-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-pentanoyl]amino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: (2S)-2-[[2-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-pentanoyl]amino]-3-naphthalen-2-yl-propanoic acid Openeye Name: (2S)-2-[[2-(2-methoxy-2-oxo-ethyl)-4-methyl-pentanoyl]amino]-3-(2-naphthyl)propanoic acid CAS Name: (2S)-2-[[2-(2-methoxy-2-oxoethyl)-4-methyl-1-oxopentyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: (2S)-2-[[2-(2-methoxy-2-oxoethyl)-4-methylpentanoyl]amino]-3-naphthalen-2-ylpropanoic acid Traditional Name: (2S)-2-[[2-(2-keto-2-methoxy-ethyl)-4-methyl-pentanoyl]amino]-3-(2-naphthyl)propionic acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)OC)C(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO5/c1-14(2)10-18(13-20(24)28-3)21(25)23-19(22(26)27)12-15-8-9-16-6-4-5-7-17(16)11-15/h4-9,11,14,18-19H,10,12-13H2,1-3H3,(H,23,25)(H,26,27)/t18?,19-/m0/s1