3-methylbutyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)carbonylamino]prop-2-enoate

Systemtic Name: 3-methylbutyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)carbonylamino]prop-2-enoate Openeye Name: isopentyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxybenzoyl)amino]prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[[(4-methoxyphenyl)-oxomethyl]amino]-2-propenoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxybenzoyl)amino]prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(p-anisoylamino)acrylic acid isoamyl ester Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CCOC(=O)/C(=C\C1=CC2=C(C=C1)OCO2)/NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H25NO6/c1-15(2)10-11-28-23(26)19(12-16-4-9-20-21(13-16)30-14-29-20)24-22(25)17-5-7-18(27-3)8-6-17/h4-9,12-13,15H,10-11,14H2,1-3H3,(H,24,25)/b19-12+