2-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-4-oxidanylidene-4-(4-oxidanylpiperidin-1-yl)butanoic acid

Systemtic Name: 2-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-4-oxidanylidene-4-(4-oxidanylpiperidin-1-yl)butanoic acid Openeye Name: 2-[(5-chloro-1H-indole-2-carbonyl)amino]-4-(4-hydroxy-1-piperidyl)-4-oxo-butanoic acid CAS Name: 2-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-4-(4-hydroxy-1-piperidinyl)-4-oxobutanoic acid IUPAC Name: 2-[(5-chloro-1H-indole-2-carbonyl)amino]-4-(4-hydroxypiperidin-1-yl)-4-oxobutanoic acid Traditional Name: 2-[(5-chloro-1H-indole-2-carbonyl)amino]-4-(4-hydroxypiperidino)-4-keto-butyric acid Formula: C18H20ClN3O5 MolecularWeight: 393.8215

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)CC(C(=O)O)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C1CN(CCC1O)C(=O)CC(C(=O)O)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C18H20ClN3O5/c19-11-1-2-13-10(7-11)8-14(20-13)17(25)21-15(18(26)27)9-16(24)22-5-3-12(23)4-6-22/h1-2,7-8,12,15,20,23H,3-6,9H2,(H,21,25)(H,26,27)