(E)-1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(azepane-1-carbonyl)-1-piperidyl]-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-en-1-one CAS Name: (E)-1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(azepane-1-carbonyl)piperidin-1-yl]-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(azepane-1-carbonyl)piperidino]-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-en-1-one Formula: C24H35N3O2 MolecularWeight: 397.5536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=CC(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=C/C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C24H35N3O2/c1-18-17-21(19(2)27(18)22-8-9-22)7-10-23(28)25-15-11-20(12-16-25)24(29)26-13-5-3-4-6-14-26/h7,10,17,20,22H,3-6,8-9,11-16H2,1-2H3/b10-7+