N-[(3R,4S)-3-(4-methoxyphenyl)-5-oxidanylidene-pyrazolidin-4-yl]-3-methyl-benzamide

Systemtic Name: N-[(3R,4S)-3-(4-methoxyphenyl)-5-oxidanylidene-pyrazolidin-4-yl]-3-methyl-benzamide Openeye Name: N-[(3R,4S)-3-(4-methoxyphenyl)-5-oxo-pyrazolidin-4-yl]-3-methyl-benzamide CAS Name: N-[(3R,4S)-3-(4-methoxyphenyl)-5-oxo-4-pyrazolidinyl]-3-methylbenzamide IUPAC Name: N-[(3R,4S)-3-(4-methoxyphenyl)-5-oxopyrazolidin-4-yl]-3-methylbenzamide Traditional Name: N-[(4S,5R)-3-keto-5-(4-methoxyphenyl)pyrazolidin-4-yl]-3-methyl-benzamide Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2C(NNC2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@H]2[C@H](NNC2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H19N3O3/c1-11-4-3-5-13(10-11)17(22)19-16-15(20-21-18(16)23)12-6-8-14(24-2)9-7-12/h3-10,15-16,20H,1-2H3,(H,19,22)(H,21,23)/t15-,16+/m1/s1