4-[(3aS,7aS)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-chloranyl-2-methyl-phenyl)butanamide

Systemtic Name: 4-[(3aS,7aS)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-chloranyl-2-methyl-phenyl)butanamide Openeye Name: 4-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-chloro-2-methyl-phenyl)butanamide CAS Name: 4-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-chloro-2-methylphenyl)butanamide IUPAC Name: 4-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-chloro-2-methylphenyl)butanamide Traditional Name: 4-[(3aS,7aS)-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-chloro-2-methyl-phenyl)butyramide Formula: C19H21ClN2O3 MolecularWeight: 360.83464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CCCN2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CCCN2C(=O)[C@H]3CC=CC[C@@H]3C2=O

InChI

InChI=1S/C19H21ClN2O3/c1-12-15(20)8-4-9-16(12)21-17(23)10-5-11-22-18(24)13-6-2-3-7-14(13)19(22)25/h2-4,8-9,13-14H,5-7,10-11H2,1H3,(H,21,23)/t13-,14-/m0/s1