[1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: [1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: [1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid [1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-asarylacrylic acid [2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C25H25NO6 MolecularWeight: 435.4691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C=CC3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)/C=C/C3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C25H25NO6/c1-16(25(28)26-20-11-7-9-17-8-5-6-10-19(17)20)32-24(27)13-12-18-14-22(30-3)23(31-4)15-21(18)29-2/h5-16H,1-4H3,(H,26,28)/b13-12+