ethyl 4-[(E)-2-[(2-chlorophenyl)carbonylamino]-3-(4-nitrophenyl)prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(E)-2-[(2-chlorophenyl)carbonylamino]-3-(4-nitrophenyl)prop-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(E)-2-[(2-chlorobenzoyl)amino]-3-(4-nitrophenyl)prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-2-[[(2-chlorophenyl)-oxomethyl]amino]-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-[(2-chlorobenzoyl)amino]-3-(4-nitrophenyl)prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-2-[(2-chlorobenzoyl)amino]-3-(4-nitrophenyl)acryloyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H23ClN4O6 MolecularWeight: 486.90492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H23ClN4O6/c1-2-34-23(31)27-13-11-26(12-14-27)22(30)20(15-16-7-9-17(10-8-16)28(32)33)25-21(29)18-5-3-4-6-19(18)24/h3-10,15H,2,11-14H2,1H3,(H,25,29)/b20-15+