3-[4-[3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-[3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-[3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[3-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]-3,5-dimethyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-[3-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]-3,5-dimethylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[3-keto-3-(2-p-phenetylpyrrolidino)propyl]-3,5-dimethyl-pyrazol-1-yl]propionitrile Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CCC3=C(N(N=C3C)CCC#N)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CCC3=C(N(N=C3C)CCC#N)C

InChI

InChI=1S/C23H30N4O2/c1-4-29-20-10-8-19(9-11-20)22-7-5-15-26(22)23(28)13-12-21-17(2)25-27(18(21)3)16-6-14-24/h8-11,22H,4-7,12-13,15-16H2,1-3H3