1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(5-nitropyridin-2-yl)amino]propan-1-one

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(5-nitropyridin-2-yl)amino]propan-1-one Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(5-nitro-2-pyridyl)amino]propan-1-one CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-[(5-nitro-2-pyridinyl)amino]-1-propanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(5-nitropyridin-2-yl)amino]propan-1-one Traditional Name: 1-[4-(4-methoxyphenyl)piperazino]-3-[(5-nitro-2-pyridyl)amino]propan-1-one Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O4/c1-28-17-5-2-15(3-6-17)22-10-12-23(13-11-22)19(25)8-9-20-18-7-4-16(14-21-18)24(26)27/h2-7,14H,8-13H2,1H3,(H,20,21)