[4-[3-(ethylamino)-4-nitro-phenyl]piperazin-1-yl]-(4-propan-2-yloxyphenyl)methanone

Systemtic Name: [4-[3-(ethylamino)-4-nitro-phenyl]piperazin-1-yl]-(4-propan-2-yloxyphenyl)methanone Openeye Name: [4-[3-(ethylamino)-4-nitro-phenyl]piperazin-1-yl]-(4-isopropoxyphenyl)methanone CAS Name: [4-[3-(ethylamino)-4-nitrophenyl]-1-piperazinyl]-(4-propan-2-yloxyphenyl)methanone IUPAC Name: [4-[3-(ethylamino)-4-nitrophenyl]piperazin-1-yl]-(4-propan-2-yloxyphenyl)methanone Traditional Name: [4-[3-(ethylamino)-4-nitro-phenyl]piperazino]-(4-isopropoxyphenyl)methanone Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c1-4-23-20-15-18(7-10-21(20)26(28)29)24-11-13-25(14-12-24)22(27)17-5-8-19(9-6-17)30-16(2)3/h5-10,15-16,23H,4,11-14H2,1-3H3