4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]-3-methyl-phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]-3-methyl-phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]-3-methyl-phenyl]benzonitrile CAS Name: 4-[4-[3-[3-(dimethylamino)-1-pyrrolidinyl]propoxy]-3-methylphenyl]benzonitrile IUPAC Name: 4-[4-[3-[3-(dimethylamino)pyrrolidin-1-yl]propoxy]-3-methylphenyl]benzonitrile Traditional Name: 4-[4-[3-[3-(dimethylamino)pyrrolidino]propoxy]-3-methyl-phenyl]benzonitrile Formula: C23H29N3O MolecularWeight: 363.49586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)OCCCN3CCC(C3)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)OCCCN3CCC(C3)N(C)C

InChI

InChI=1S/C23H29N3O/c1-18-15-21(20-7-5-19(16-24)6-8-20)9-10-23(18)27-14-4-12-26-13-11-22(17-26)25(2)3/h5-10,15,22H,4,11-14,17H2,1-3H3