N-cyclopropyl-2-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]amino]benzamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2CC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

InChI=1S/C25H31N3O3/c1-31-20-14-10-18(11-15-20)23-9-3-2-6-16-28(23)17-24(29)27-22-8-5-4-7-21(22)25(30)26-19-12-13-19/h4-5,7-8,10-11,14-15,19,23H,2-3,6,9,12-13,16-17H2,1H3,(H,26,30)(H,27,29)/t23-/m1/s1