(2S)-2-[2-(3-ethanoylindol-1-yl)ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[2-(3-ethanoylindol-1-yl)ethanoylamino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[2-(3-acetyl-1-indolyl)-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-4-methyl-valeric acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4/c1-11(2)8-15(18(23)24)19-17(22)10-20-9-14(12(3)21)13-6-4-5-7-16(13)20/h4-7,9,11,15H,8,10H2,1-3H3,(H,19,22)(H,23,24)/t15-/m0/s1