(3R)-3-[(4-chlorophenyl)methyl]-4-(cyclohexylamino)-4-oxidanylidene-butanoate

Systemtic Name: (3R)-3-[(4-chlorophenyl)methyl]-4-(cyclohexylamino)-4-oxidanylidene-butanoate Openeye Name: (3R)-3-[(4-chlorophenyl)methyl]-4-(cyclohexylamino)-4-oxo-butanoate CAS Name: (3R)-3-[(4-chlorophenyl)methyl]-4-(cyclohexylamino)-4-oxobutanoate IUPAC Name: (3R)-3-[(4-chlorophenyl)methyl]-4-(cyclohexylamino)-4-oxobutanoate Traditional Name: (3R)-3-(4-chlorobenzyl)-4-(cyclohexylamino)-4-keto-butyrate Formula: C17H21ClNO3- MolecularWeight: 322.80654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(CC2=CC=C(C=C2)Cl)CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@H](CC2=CC=C(C=C2)Cl)CC(=O)[O-]

InChI

InChI=1S/C17H22ClNO3/c18-14-8-6-12(7-9-14)10-13(11-16(20)21)17(22)19-15-4-2-1-3-5-15/h6-9,13,15H,1-5,10-11H2,(H,19,22)(H,20,21)/p-1/t13-/m1/s1