2-[(2S)-1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-3-naphthalen-1-yloxy-benzenecarbonitrile

Systemtic Name: 2-[(2S)-1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-3-naphthalen-1-yloxy-benzenecarbonitrile Openeye Name: 2-[(2S)-1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-3-(1-naphthyloxy)benzonitrile CAS Name: 2-[(2S)-1-(3-methyl-4-imidazolyl)-2-pyrrolidinyl]-3-(1-naphthalenyloxy)benzonitrile IUPAC Name: 2-[(2S)-1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-3-naphthalen-1-yloxybenzonitrile Traditional Name: 2-[(2S)-1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-3-(1-naphthoxy)benzonitrile Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1N2CCCC2C3=C(C=CC=C3OC4=CC=CC5=CC=CC=C54)C#N

Isomeric SMILES

CN1C=NC=C1N2CCC[C@H]2C3=C(C=CC=C3OC4=CC=CC5=CC=CC=C54)C#N

InChI

InChI=1S/C25H22N4O/c1-28-17-27-16-24(28)29-14-6-11-21(29)25-19(15-26)9-5-13-23(25)30-22-12-4-8-18-7-2-3-10-20(18)22/h2-5,7-10,12-13,16-17,21H,6,11,14H2,1H3/t21-/m0/s1