(2S)-2-[[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]carbonylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[4-(1H-indole-2-carbonyl)piperazine-1-carbonyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[[4-[1H-indol-2-yl(oxo)methyl]-1-piperazinyl]-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[4-(1H-indole-2-carbonyl)piperazine-1-carbonyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[4-(1H-indole-2-carbonyl)piperazine-1-carbonyl]amino]-3-methyl-butyrate Formula: C19H23N4O4- MolecularWeight: 371.41032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C19H24N4O4/c1-12(2)16(18(25)26)21-19(27)23-9-7-22(8-10-23)17(24)15-11-13-5-3-4-6-14(13)20-15/h3-6,11-12,16,20H,7-10H2,1-2H3,(H,21,27)(H,25,26)/p-1/t16-/m0/s1