(E)-1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(2-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(2-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(2-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-3-(2-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(2-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-(2,4-dimethoxyphenyl)pyrrolidino]-3-(2-nitrophenyl)prop-2-en-1-one Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C(=O)C=CC3=CC=CC=C3[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2C(=O)/C=C/C3=CC=CC=C3[N+](=O)[O-])OC

InChI

InChI=1S/C21H22N2O5/c1-27-16-10-11-17(20(14-16)28-2)19-8-5-13-22(19)21(24)12-9-15-6-3-4-7-18(15)23(25)26/h3-4,6-7,9-12,14,19H,5,8,13H2,1-2H3/b12-9+