(phenylmethyl) 2-azanyl-2-[4-methyl-2-(quinolin-8-ylsulfonylamino)pentanoyl]-3-oxidanylidene-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-azanyl-2-[4-methyl-2-(quinolin-8-ylsulfonylamino)pentanoyl]-3-oxidanylidene-piperidine-1-carboxylate Openeye Name: benzyl 2-amino-2-[4-methyl-2-(8-quinolylsulfonylamino)pentanoyl]-3-oxo-piperidine-1-carboxylate CAS Name: 2-amino-2-[4-methyl-1-oxo-2-(8-quinolinylsulfonylamino)pentyl]-3-oxo-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-2-[4-methyl-2-(quinolin-8-ylsulfonylamino)pentanoyl]-3-oxopiperidine-1-carboxylate Traditional Name: 2-amino-3-keto-2-[4-methyl-2-(8-quinolylsulfonylamino)pentanoyl]piperidine-1-carboxylic acid benzyl ester Formula: C28H32N4O6S MolecularWeight: 552.64188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1(C(=O)CCCN1C(=O)OCC2=CC=CC=C2)N)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(C)CC(C(=O)C1(C(=O)CCCN1C(=O)OCC2=CC=CC=C2)N)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C28H32N4O6S/c1-19(2)17-22(31-39(36,37)23-13-6-11-21-12-7-15-30-25(21)23)26(34)28(29)24(33)14-8-16-32(28)27(35)38-18-20-9-4-3-5-10-20/h3-7,9-13,15,19,22,31H,8,14,16-18,29H2,1-2H3