methyl (E)-3-[3-[cyclohexylcarbonyl-[(4-phenylphenyl)methyl]amino]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-[cyclohexylcarbonyl-[(4-phenylphenyl)methyl]amino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-[cyclohexanecarbonyl-[(4-phenylphenyl)methyl]amino]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[[cyclohexyl(oxo)methyl]-[(4-phenylphenyl)methyl]amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[cyclohexanecarbonyl-[(4-phenylphenyl)methyl]amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[cyclohexanecarbonyl-(4-phenylbenzyl)amino]phenyl]acrylic acid methyl ester Formula: C30H31NO3 MolecularWeight: 453.57204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)C4CCCCC4

Isomeric SMILES

COC(=O)/C=C/C1=CC(=CC=C1)N(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)C4CCCCC4

InChI

InChI=1S/C30H31NO3/c1-34-29(32)20-17-23-9-8-14-28(21-23)31(30(33)27-12-6-3-7-13-27)22-24-15-18-26(19-16-24)25-10-4-2-5-11-25/h2,4-5,8-11,14-21,27H,3,6-7,12-13,22H2,1H3/b20-17+