(phenylmethyl) (Z)-2-[(4-butoxyphenyl)carbonylamino]-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (phenylmethyl) (Z)-2-[(4-butoxyphenyl)carbonylamino]-3-(3-nitrophenyl)prop-2-enoate Openeye Name: benzyl (Z)-2-[(4-butoxybenzoyl)amino]-3-(3-nitrophenyl)prop-2-enoate CAS Name: (Z)-2-[[(4-butoxyphenyl)-oxomethyl]amino]-3-(3-nitrophenyl)-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl (Z)-2-[(4-butoxybenzoyl)amino]-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (Z)-2-[(4-butoxybenzoyl)amino]-3-(3-nitrophenyl)acrylic acid benzyl ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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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)OCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H26N2O6/c1-2-3-16-34-24-14-12-22(13-15-24)26(30)28-25(18-21-10-7-11-23(17-21)29(32)33)27(31)35-19-20-8-5-4-6-9-20/h4-15,17-18H,2-3,16,19H2,1H3,(H,28,30)/b25-18-