(E)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-3-(4-propan-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-3-(4-propan-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-isopropylpiperazin-1-yl)-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one CAS Name: (E)-1-[3-nitro-4-(1-pyrrolidinyl)phenyl]-3-(4-propan-2-yl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-1-(3-nitro-4-pyrrolidin-1-ylphenyl)-3-(4-propan-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(4-isopropylpiperazino)-1-(3-nitro-4-pyrrolidino-phenyl)prop-2-en-1-one Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C=CC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1CCN(CC1)/C=C/C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O3/c1-16(2)22-13-11-21(12-14-22)10-7-20(25)17-5-6-18(19(15-17)24(26)27)23-8-3-4-9-23/h5-7,10,15-16H,3-4,8-9,11-14H2,1-2H3/b10-7+