(3S)-1-[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyl-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(2-isopentyl-1,3-dioxo-isoindoline-5-carbonyl)-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[[2-(3-methylbutyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(3-methylbutyl)-1,3-dioxoisoindole-5-carbonyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-(2-isoamyl-1,3-diketo-isoindoline-5-carbonyl)-N-phenyl-nipecotamide Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC[C@@H](C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4/c1-17(2)12-14-29-25(32)21-11-10-18(15-22(21)26(29)33)24(31)28-13-6-7-19(16-28)23(30)27-20-8-4-3-5-9-20/h3-5,8-11,15,17,19H,6-7,12-14,16H2,1-2H3,(H,27,30)/t19-/m0/s1