(3-methoxy-4-methyl-phenyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone

Systemtic Name: (3-methoxy-4-methyl-phenyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone Openeye Name: (3-methoxy-4-methyl-phenyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone CAS Name: (3-methoxy-4-methylphenyl)-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone IUPAC Name: (3-methoxy-4-methylphenyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone Traditional Name: (3-methoxy-4-methyl-phenyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCCCC2C3=CC=CN3C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCCCC2C3=CC=CN3C)OC

InChI

InChI=1S/C20H26N2O2/c1-15-10-11-16(14-19(15)24-3)20(23)22-13-6-4-5-8-18(22)17-9-7-12-21(17)2/h7,9-12,14,18H,4-6,8,13H2,1-3H3