[2-(cycloheptylamino)-2-oxidanylidene-ethyl] (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] (2R)-2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[(4-chlorophenyl)-oxomethyl]amino]-4-methylpentanoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] (2R)-2-[(4-chlorobenzoyl)amino]-4-methylpentanoate Traditional Name: (2R)-2-[(4-chlorobenzoyl)amino]-4-methyl-valeric acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C22H31ClN2O4 MolecularWeight: 422.94554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC(=O)NC1CCCCCC1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C[C@H](C(=O)OCC(=O)NC1CCCCCC1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H31ClN2O4/c1-15(2)13-19(25-21(27)16-9-11-17(23)12-10-16)22(28)29-14-20(26)24-18-7-5-3-4-6-8-18/h9-12,15,18-19H,3-8,13-14H2,1-2H3,(H,24,26)(H,25,27)/t19-/m1/s1