N-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)CN2CCCCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)CN2CCCCC[C@@H]2C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O3/c1-23-13-6-8-19(23)21(26)22-20(25)15-24-14-5-3-4-7-18(24)16-9-11-17(27-2)12-10-16/h6,8-13,18H,3-5,7,14-15H2,1-2H3,(H,22,25,26)/t18-/m1/s1