(phenylmethyl) (Z)-2-[(4-tert-butylphenyl)carbonylamino]-3-(4-chlorophenyl)prop-2-enoate

Systemtic Name: (phenylmethyl) (Z)-2-[(4-tert-butylphenyl)carbonylamino]-3-(4-chlorophenyl)prop-2-enoate Openeye Name: benzyl (Z)-2-[(4-tert-butylbenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate CAS Name: (Z)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-(4-chlorophenyl)-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl (Z)-2-[(4-tert-butylbenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate Traditional Name: (Z)-2-[(4-tert-butylbenzoyl)amino]-3-(4-chlorophenyl)acrylic acid benzyl ester Formula: C27H26ClNO3 MolecularWeight: 447.95324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)Cl)/C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H26ClNO3/c1-27(2,3)22-13-11-21(12-14-22)25(30)29-24(17-19-9-15-23(28)16-10-19)26(31)32-18-20-7-5-4-6-8-20/h4-17H,18H2,1-3H3,(H,29,30)/b24-17-