ethyl 5-(3-methoxyphenyl)-1-[4-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(3-methoxyphenyl)-1-[4-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-(3-methoxyphenyl)-1-[4-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]pyrazole-3-carboxylate CAS Name: 5-(3-methoxyphenyl)-1-[4-[oxo-[[(2S)-2-phenylpropyl]amino]methyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-methoxyphenyl)-1-[4-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]pyrazole-3-carboxylate Traditional Name: 5-(3-methoxyphenyl)-1-[4-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C29H29N3O4 MolecularWeight: 483.55826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC(=CC=C2)OC)C3=CC=C(C=C3)C(=O)NCC(C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC(=CC=C2)OC)C3=CC=C(C=C3)C(=O)NC[C@@H](C)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O4/c1-4-36-29(34)26-18-27(23-11-8-12-25(17-23)35-3)32(31-26)24-15-13-22(14-16-24)28(33)30-19-20(2)21-9-6-5-7-10-21/h5-18,20H,4,19H2,1-3H3,(H,30,33)/t20-/m1/s1