hexyl 4-[[(E)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: hexyl 4-[[(E)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: hexyl 4-[[(E)-3-(4-benzyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(3-methoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[(E)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-benzoxy-3-methoxy-phenyl)acryloyl]amino]benzoic acid hexyl ester Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C30H33NO5/c1-3-4-5-9-20-35-30(33)25-14-16-26(17-15-25)31-29(32)19-13-23-12-18-27(28(21-23)34-2)36-22-24-10-7-6-8-11-24/h6-8,10-19,21H,3-5,9,20,22H2,1-2H3,(H,31,32)/b19-13+