2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid

Systemtic Name: 2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid Openeye Name: 2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid CAS Name: 2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-4-(1H-indol-3-yl)butanoic acid IUPAC Name: 2-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid Traditional Name: 2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butyric acid Formula: C18H25N3O3 MolecularWeight: 331.4094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCC1=CNC2=CC=CC=C21)C(=O)O)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(CCC1=CNC2=CC=CC=C21)C(=O)O)N

InChI

InChI=1S/C18H25N3O3/c1-11(2)9-14(19)17(22)21-16(18(23)24)8-7-12-10-20-15-6-4-3-5-13(12)15/h3-6,10-11,14,16,20H,7-9,19H2,1-2H3,(H,21,22)(H,23,24)/t14-,16?/m0/s1