azepan-1-yl-[1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]-4-piperidyl]methanone Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C25H33N3O2/c1-19-7-8-20(2)28(19)23-11-9-21(10-12-23)24(29)27-17-13-22(14-18-27)25(30)26-15-5-3-4-6-16-26/h7-12,22H,3-6,13-18H2,1-2H3