4-chloranyl-2-[4-(1-oxidanylpropan-2-ylamino)-1-phenyl-butoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[4-(1-oxidanylpropan-2-ylamino)-1-phenyl-butoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[4-[(2-hydroxy-1-methyl-ethyl)amino]-1-phenyl-butoxy]benzonitrile CAS Name: 4-chloro-2-[4-(1-hydroxypropan-2-ylamino)-1-phenylbutoxy]benzonitrile IUPAC Name: 4-chloro-2-[4-(1-hydroxypropan-2-ylamino)-1-phenylbutoxy]benzonitrile Traditional Name: 4-chloro-2-[4-[(2-hydroxy-1-methyl-ethyl)amino]-1-phenyl-butoxy]benzonitrile Formula: C20H23ClN2O2 MolecularWeight: 358.86182

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NCCCC(C1=CC=CC=C1)OC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CC(CO)NCCCC(C1=CC=CC=C1)OC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C20H23ClN2O2/c1-15(14-24)23-11-5-8-19(16-6-3-2-4-7-16)25-20-12-18(21)10-9-17(20)13-22/h2-4,6-7,9-10,12,15,19,23-24H,5,8,11,14H2,1H3