(2R,3S)-2-[4-(1H-indol-3-yl)butanoylamino]-3-methyl-pentanoate

Systemtic Name: (2R,3S)-2-[4-(1H-indol-3-yl)butanoylamino]-3-methyl-pentanoate Openeye Name: (2R,3S)-2-[4-(1H-indol-3-yl)butanoylamino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]-3-methylpentanoate IUPAC Name: (2R,3S)-2-[4-(1H-indol-3-yl)butanoylamino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[4-(1H-indol-3-yl)butanoylamino]-3-methyl-valerate Formula: C18H23N2O3- MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CCCC1=CNC2=CC=CC=C21

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])NC(=O)CCCC1=CNC2=CC=CC=C21

InChI

InChI=1S/C18H24N2O3/c1-3-12(2)17(18(22)23)20-16(21)10-6-7-13-11-19-15-9-5-4-8-14(13)15/h4-5,8-9,11-12,17,19H,3,6-7,10H2,1-2H3,(H,20,21)(H,22,23)/p-1/t12-,17+/m0/s1