3-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-4-oxidanylidene-4-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]butanoic acid

Systemtic Name: 3-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-4-oxidanylidene-4-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]butanoic acid Openeye Name: 3-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-[(2-hydroxy-1-methyl-2-oxo-ethyl)amino]-4-oxo-butanoic acid CAS Name: 3-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-4-[(1-hydroxy-1-oxopropan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-[(1-hydroxy-1-oxopropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-[(2-hydroxy-2-keto-1-methyl-ethyl)amino]-4-keto-butyric acid Formula: C18H22N4O6 MolecularWeight: 390.39048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CC1=CNC2=CC=CC=C21)N

Isomeric SMILES

CC(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CC1=CNC2=CC=CC=C21)N

InChI

InChI=1S/C18H22N4O6/c1-9(18(27)28)21-17(26)14(7-15(23)24)22-16(25)12(19)6-10-8-20-13-5-3-2-4-11(10)13/h2-5,8-9,12,14,20H,6-7,19H2,1H3,(H,21,26)(H,22,25)(H,23,24)(H,27,28)