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

Systemtic Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-4-hexoxy-benzamide Openeye Name: N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-4-hexoxy-benzamide CAS Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-4-hexoxybenzamide IUPAC Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-4-hexoxybenzamide Traditional Name: N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-4-hexoxy-benzamide Formula: C22H37N3O3 MolecularWeight: 391.54748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(CCC)C(=O)NCCN(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)N[C@@H](CCC)C(=O)NCCN(C)C

InChI

InChI=1S/C22H37N3O3/c1-5-7-8-9-17-28-19-13-11-18(12-14-19)21(26)24-20(10-6-2)22(27)23-15-16-25(3)4/h11-14,20H,5-10,15-17H2,1-4H3,(H,23,27)(H,24,26)/t20-/m0/s1