prop-2-enyl (E)-2-[(4-butoxyphenyl)carbonylamino]-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-[(4-butoxyphenyl)carbonylamino]-3-(3-nitrophenyl)prop-2-enoate Openeye Name: allyl (E)-2-[(4-butoxybenzoyl)amino]-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-2-[[(4-butoxyphenyl)-oxomethyl]amino]-3-(3-nitrophenyl)-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-[(4-butoxybenzoyl)amino]-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-[(4-butoxybenzoyl)amino]-3-(3-nitrophenyl)acrylic acid allyl ester Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC=C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)OCC=C

InChI

InChI=1S/C23H24N2O6/c1-3-5-14-30-20-11-9-18(10-12-20)22(26)24-21(23(27)31-13-4-2)16-17-7-6-8-19(15-17)25(28)29/h4,6-12,15-16H,2-3,5,13-14H2,1H3,(H,24,26)/b21-16+