2-naphthalen-1-ylethyl 4-[1-[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-2-oxidanylidene-2-phenylmethoxy-ethyl]piperidine-1-carboxylate

Systemtic Name: 2-naphthalen-1-ylethyl 4-[1-[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-2-oxidanylidene-2-phenylmethoxy-ethyl]piperidine-1-carboxylate Openeye Name: 2-(1-naphthyl)ethyl 4-[2-benzyloxy-1-[(4-methoxyphenyl)sulfonyl-(4-pyridylmethyl)amino]-2-oxo-ethyl]piperidine-1-carboxylate CAS Name: 4-[1-[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-2-oxo-2-phenylmethoxyethyl]-1-piperidinecarboxylic acid 2-(1-naphthalenyl)ethyl ester IUPAC Name: 2-naphthalen-1-ylethyl 4-[1-[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-2-oxo-2-phenylmethoxyethyl]piperidine-1-carboxylate Traditional Name: 4-[2-benzoxy-2-keto-1-[(4-methoxyphenyl)sulfonyl-(4-pyridylmethyl)amino]ethyl]piperidine-1-carboxylic acid 2-(1-naphthyl)ethyl ester Formula: C40H41N3O7S MolecularWeight: 707.83444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=NC=C2)C(C3CCN(CC3)C(=O)OCCC4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=NC=C2)C(C3CCN(CC3)C(=O)OCCC4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C40H41N3O7S/c1-48-35-14-16-36(17-15-35)51(46,47)43(28-30-18-23-41-24-19-30)38(39(44)50-29-31-8-3-2-4-9-31)34-20-25-42(26-21-34)40(45)49-27-22-33-12-7-11-32-10-5-6-13-37(32)33/h2-19,23-24,34,38H,20-22,25-29H2,1H3