propan-2-yl 4-[[(E)-3-(3-methoxy-4-pentoxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: propan-2-yl 4-[[(E)-3-(3-methoxy-4-pentoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: isopropyl 4-[[(E)-3-(3-methoxy-4-pentoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(3-methoxy-4-pentoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[(E)-3-(3-methoxy-4-pentoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-amoxy-3-methoxy-phenyl)acryloyl]amino]benzoic acid isopropyl ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)OC(C)C)OC

InChI

InChI=1S/C25H31NO5/c1-5-6-7-16-30-22-14-8-19(17-23(22)29-4)9-15-24(27)26-21-12-10-20(11-13-21)25(28)31-18(2)3/h8-15,17-18H,5-7,16H2,1-4H3,(H,26,27)/b15-9+