methyl (E)-2-(3-cyclopentylpropanoylamino)-3-[4-[(3-methylphenyl)methoxy]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-2-(3-cyclopentylpropanoylamino)-3-[4-[(3-methylphenyl)methoxy]phenyl]prop-2-enoate Openeye Name: methyl (E)-2-(3-cyclopentylpropanoylamino)-3-[4-(m-tolylmethoxy)phenyl]prop-2-enoate CAS Name: (E)-2-[(3-cyclopentyl-1-oxopropyl)amino]-3-[4-[(3-methylphenyl)methoxy]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-(3-cyclopentylpropanoylamino)-3-[4-[(3-methylphenyl)methoxy]phenyl]prop-2-enoate Traditional Name: (E)-2-(3-cyclopentylpropanoylamino)-3-[4-(3-methylbenzyl)oxyphenyl]acrylic acid methyl ester Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=C(C=C2)C=C(C(=O)OC)NC(=O)CCC3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=C(C=C2)/C=C(\C(=O)OC)/NC(=O)CCC3CCCC3

InChI

InChI=1S/C26H31NO4/c1-19-6-5-9-22(16-19)18-31-23-13-10-21(11-14-23)17-24(26(29)30-2)27-25(28)15-12-20-7-3-4-8-20/h5-6,9-11,13-14,16-17,20H,3-4,7-8,12,15,18H2,1-2H3,(H,27,28)/b24-17+