2-azanyl-2-(3-chlorophenyl)carbonyl-5-(cycloheptylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-2-(3-chlorophenyl)carbonyl-5-(cycloheptylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-2-(3-chlorobenzoyl)-5-(cycloheptylamino)-5-oxo-pentanoic acid CAS Name: 2-amino-2-[(3-chlorophenyl)-oxomethyl]-5-(cycloheptylamino)-5-oxopentanoic acid IUPAC Name: 2-amino-2-(3-chlorobenzoyl)-5-(cycloheptylamino)-5-oxopentanoic acid Traditional Name: 2-amino-2-(3-chlorobenzoyl)-5-(cycloheptylamino)-5-keto-valeric acid Formula: C19H25ClN2O4 MolecularWeight: 380.8658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCC(C(=O)C2=CC(=CC=C2)Cl)(C(=O)O)N

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCC(C(=O)C2=CC(=CC=C2)Cl)(C(=O)O)N

InChI

InChI=1S/C19H25ClN2O4/c20-14-7-5-6-13(12-14)17(24)19(21,18(25)26)11-10-16(23)22-15-8-3-1-2-4-9-15/h5-7,12,15H,1-4,8-11,21H2,(H,22,23)(H,25,26)