(E)-1-(4-chloranyl-3-nitro-phenyl)-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-chloranyl-3-nitro-phenyl)-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-[2-(1-piperidylmethyl)pyrrolidin-1-yl]prop-2-en-1-one CAS Name: (E)-1-(4-chloro-3-nitrophenyl)-3-[2-(1-piperidinylmethyl)-1-pyrrolidinyl]-2-propen-1-one IUPAC Name: (E)-1-(4-chloro-3-nitrophenyl)-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-2-en-1-one Traditional Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-[2-(piperidinomethyl)pyrrolidino]prop-2-en-1-one Formula: C19H24ClN3O3 MolecularWeight: 377.86516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2CCCN2C=CC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2CCCN2/C=C/C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H24ClN3O3/c20-17-7-6-15(13-18(17)23(25)26)19(24)8-12-22-11-4-5-16(22)14-21-9-2-1-3-10-21/h6-8,12-13,16H,1-5,9-11,14H2/b12-8+