methyl (1S,2S,3S)-1-benzamido-2-(4-methoxyphenyl)-3-phenyl-cyclopropane-1-carboxylate

Systemtic Name: methyl (1S,2S,3S)-1-benzamido-2-(4-methoxyphenyl)-3-phenyl-cyclopropane-1-carboxylate Openeye Name: methyl (1S,2S,3S)-1-benzamido-2-(4-methoxyphenyl)-3-phenyl-cyclopropanecarboxylate CAS Name: (1S,2S,3S)-1-benzamido-2-(4-methoxyphenyl)-3-phenyl-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S,3S)-1-benzamido-2-(4-methoxyphenyl)-3-phenylcyclopropane-1-carboxylate Traditional Name: (1S,2S,3S)-1-benzamido-2-(4-methoxyphenyl)-3-phenyl-cyclopropanecarboxylic acid methyl ester Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C2(C(=O)OC)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H]([C@]2(C(=O)OC)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23NO4/c1-29-20-15-13-18(14-16-20)22-21(17-9-5-3-6-10-17)25(22,24(28)30-2)26-23(27)19-11-7-4-8-12-19/h3-16,21-22H,1-2H3,(H,26,27)/t21-,22-,25+/m1/s1