(2S,3R)-2-[2-(3-ethanoylindol-1-yl)ethanoylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S,3R)-2-[2-(3-ethanoylindol-1-yl)ethanoylamino]-3-methyl-pentanoic acid Openeye Name: (2S,3R)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-3-methyl-pentanoic acid CAS Name: (2S,3R)-2-[[2-(3-acetyl-1-indolyl)-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: (2S,3R)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-3-methylpentanoic acid Traditional Name: (2S,3R)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-3-methyl-valeric acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)O)NC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C

InChI

InChI=1S/C18H22N2O4/c1-4-11(2)17(18(23)24)19-16(22)10-20-9-14(12(3)21)13-7-5-6-8-15(13)20/h5-9,11,17H,4,10H2,1-3H3,(H,19,22)(H,23,24)/t11-,17+/m1/s1