N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-4-hexoxy-3,5-dimethyl-benzamide

Systemtic Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-4-hexoxy-3,5-dimethyl-benzamide Openeye Name: N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-4-hexoxy-3,5-dimethyl-benzamide CAS Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-4-hexoxy-3,5-dimethylbenzamide IUPAC Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-4-hexoxy-3,5-dimethylbenzamide Traditional Name: N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-4-hexoxy-3,5-dimethyl-benzamide Formula: C24H41N3O3 MolecularWeight: 419.60064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1C)C(=O)NC(CCC)C(=O)NCCN(C)C)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1C)C(=O)N[C@@H](CCC)C(=O)NCCN(C)C)C

InChI

InChI=1S/C24H41N3O3/c1-7-9-10-11-15-30-22-18(3)16-20(17-19(22)4)23(28)26-21(12-8-2)24(29)25-13-14-27(5)6/h16-17,21H,7-15H2,1-6H3,(H,25,29)(H,26,28)/t21-/m0/s1