N-[(2R,3S)-1-[(4-acetamidophenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-4-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(2R,3S)-1-[(4-acetamidophenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-4-methyl-cyclohexane-1-carboxamide Openeye Name: N-[(1R,2S)-1-[(4-acetamidophenyl)carbamoyl]-2-methyl-butyl]-4-methyl-cyclohexanecarboxamide CAS Name: N-[(2R,3S)-1-(4-acetamidoanilino)-3-methyl-1-oxopentan-2-yl]-4-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[(2R,3S)-1-(4-acetamidoanilino)-3-methyl-1-oxopentan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[(1R,2S)-1-[(4-acetamidophenyl)carbamoyl]-2-methyl-butyl]-4-methyl-cyclohexanecarboxamide Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)NC(=O)C)NC(=O)C2CCC(CC2)C

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)NC(=O)C2CCC(CC2)C

InChI

InChI=1S/C22H33N3O3/c1-5-15(3)20(25-21(27)17-8-6-14(2)7-9-17)22(28)24-19-12-10-18(11-13-19)23-16(4)26/h10-15,17,20H,5-9H2,1-4H3,(H,23,26)(H,24,28)(H,25,27)/t14?,15-,17?,20+/m0/s1