3-ethyl-4-[4-[(3-methylbutylamino)methyl]phenyl]benzamide

Systemtic Name: 3-ethyl-4-[4-[(3-methylbutylamino)methyl]phenyl]benzamide Openeye Name: 3-ethyl-4-[4-[(isopentylamino)methyl]phenyl]benzamide CAS Name: 3-ethyl-4-[4-[(3-methylbutylamino)methyl]phenyl]benzamide IUPAC Name: 3-ethyl-4-[4-[(3-methylbutylamino)methyl]phenyl]benzamide Traditional Name: 3-ethyl-4-[4-[(isoamylamino)methyl]phenyl]benzamide Formula: C21H28N2O MolecularWeight: 324.45982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C(=O)N)C2=CC=C(C=C2)CNCCC(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)C(=O)N)C2=CC=C(C=C2)CNCCC(C)C

InChI

InChI=1S/C21H28N2O/c1-4-17-13-19(21(22)24)9-10-20(17)18-7-5-16(6-8-18)14-23-12-11-15(2)3/h5-10,13,15,23H,4,11-12,14H2,1-3H3,(H2,22,24)