4-[2-chloranyl-6-methyl-4-[(3-methylbutylamino)methyl]phenyl]-3-methyl-benzamide

Systemtic Name: 4-[2-chloranyl-6-methyl-4-[(3-methylbutylamino)methyl]phenyl]-3-methyl-benzamide Openeye Name: 4-[2-chloro-4-[(isopentylamino)methyl]-6-methyl-phenyl]-3-methyl-benzamide CAS Name: 4-[2-chloro-6-methyl-4-[(3-methylbutylamino)methyl]phenyl]-3-methylbenzamide IUPAC Name: 4-[2-chloro-6-methyl-4-[(3-methylbutylamino)methyl]phenyl]-3-methylbenzamide Traditional Name: 4-[2-chloro-4-[(isoamylamino)methyl]-6-methyl-phenyl]-3-methyl-benzamide Formula: C21H27ClN2O MolecularWeight: 358.90488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)C2=C(C=C(C=C2Cl)CNCCC(C)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)C2=C(C=C(C=C2Cl)CNCCC(C)C)C

InChI

InChI=1S/C21H27ClN2O/c1-13(2)7-8-24-12-16-9-15(4)20(19(22)11-16)18-6-5-17(21(23)25)10-14(18)3/h5-6,9-11,13,24H,7-8,12H2,1-4H3,(H2,23,25)