N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-5-oxidanylidene-N-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-5-oxidanylidene-N-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: N-benzyl-N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-5-oxo-pyrrolidine-2-carboxamide CAS Name: N-[1-[(2,6-dimethylanilino)-oxomethyl]cyclohexyl]-5-oxo-N-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: N-benzyl-N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-5-oxopyrrolidine-2-carboxamide Traditional Name: N-benzyl-N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-5-keto-pyrrolidine-2-carboxamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)C(=O)C4CCC(=O)N4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)C(=O)C4CCC(=O)N4

InChI

InChI=1S/C27H33N3O3/c1-19-10-9-11-20(2)24(19)29-26(33)27(16-7-4-8-17-27)30(18-21-12-5-3-6-13-21)25(32)22-14-15-23(31)28-22/h3,5-6,9-13,22H,4,7-8,14-18H2,1-2H3,(H,28,31)(H,29,33)