2-methylpropyl (Z)-2-[(4-methylphenyl)carbonylamino]-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: 2-methylpropyl (Z)-2-[(4-methylphenyl)carbonylamino]-3-(3-nitrophenyl)prop-2-enoate Openeye Name: isobutyl (Z)-2-[(4-methylbenzoyl)amino]-3-(3-nitrophenyl)prop-2-enoate CAS Name: (Z)-2-[[(4-methylphenyl)-oxomethyl]amino]-3-(3-nitrophenyl)-2-propenoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (Z)-2-[(4-methylbenzoyl)amino]-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (Z)-3-(3-nitrophenyl)-2-(p-toluoylamino)acrylic acid isobutyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)OCC(C)C

InChI

InChI=1S/C21H22N2O5/c1-14(2)13-28-21(25)19(12-16-5-4-6-18(11-16)23(26)27)22-20(24)17-9-7-15(3)8-10-17/h4-12,14H,13H2,1-3H3,(H,22,24)/b19-12-