propan-2-yl (3R,4S)-3-methyl-4-[[4-[(2-methylphenyl)carbonylamino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate

Systemtic Name: propan-2-yl (3R,4S)-3-methyl-4-[[4-[(2-methylphenyl)carbonylamino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate Openeye Name: isopropyl (3R,4S)-3-methyl-4-[[4-[(2-methylbenzoyl)amino]-1-naphthyl]sulfonylamino]piperidine-1-carboxylate CAS Name: (3R,4S)-3-methyl-4-[[4-[[(2-methylphenyl)-oxomethyl]amino]-1-naphthalenyl]sulfonylamino]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (3R,4S)-3-methyl-4-[[4-[(2-methylbenzoyl)amino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate Traditional Name: (3R,4S)-3-methyl-4-[[4-(o-toluoylamino)-1-naphthyl]sulfonylamino]piperidine-1-carboxylic acid isopropyl ester Formula: C28H33N3O5S MolecularWeight: 523.64372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NS(=O)(=O)C2=CC=C(C3=CC=CC=C32)NC(=O)C4=CC=CC=C4C)C(=O)OC(C)C

Isomeric SMILES

C[C@@H]1CN(CC[C@@H]1NS(=O)(=O)C2=CC=C(C3=CC=CC=C32)NC(=O)C4=CC=CC=C4C)C(=O)OC(C)C

InChI

InChI=1S/C28H33N3O5S/c1-18(2)36-28(33)31-16-15-24(20(4)17-31)30-37(34,35)26-14-13-25(22-11-7-8-12-23(22)26)29-27(32)21-10-6-5-9-19(21)3/h5-14,18,20,24,30H,15-17H2,1-4H3,(H,29,32)/t20-,24+/m1/s1