N-[4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylphenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylphenyl]cyclopropanecarboxamide Openeye Name: N-[4-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]phenyl]cyclopropanecarboxamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)C3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)C3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H27N3O2/c1-24-14-5-7-19(24)20-6-3-2-4-15-25(20)22(27)17-10-12-18(13-11-17)23-21(26)16-8-9-16/h5,7,10-14,16,20H,2-4,6,8-9,15H2,1H3,(H,23,26)