1-[(2-chlorophenyl)methyl]-3-(2-methyl-1-oxidanyl-propyl)-2-propyl-indole-6-carbonitrile

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(2-methyl-1-oxidanyl-propyl)-2-propyl-indole-6-carbonitrile Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(1-hydroxy-2-methyl-propyl)-2-propyl-indole-6-carbonitrile CAS Name: 1-[(2-chlorophenyl)methyl]-3-(1-hydroxy-2-methylpropyl)-2-propyl-6-indolecarbonitrile IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(1-hydroxy-2-methylpropyl)-2-propylindole-6-carbonitrile Traditional Name: 1-(2-chlorobenzyl)-3-(1-hydroxy-2-methyl-propyl)-2-propyl-indole-6-carbonitrile Formula: C23H25ClN2O MolecularWeight: 380.9104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C#N)C(C(C)C)O

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C#N)C(C(C)C)O

InChI

InChI=1S/C23H25ClN2O/c1-4-7-20-22(23(27)15(2)3)18-11-10-16(13-25)12-21(18)26(20)14-17-8-5-6-9-19(17)24/h5-6,8-12,15,23,27H,4,7,14H2,1-3H3