3-(4-azanylbutyl)-2-(2-methoxy-3-methyl-phenyl)-1H-indole-5-carbonitrile

Systemtic Name: 3-(4-azanylbutyl)-2-(2-methoxy-3-methyl-phenyl)-1H-indole-5-carbonitrile Openeye Name: 3-(4-aminobutyl)-2-(2-methoxy-3-methyl-phenyl)-1H-indole-5-carbonitrile CAS Name: 3-(4-aminobutyl)-2-(2-methoxy-3-methylphenyl)-1H-indole-5-carbonitrile IUPAC Name: 3-(4-aminobutyl)-2-(2-methoxy-3-methylphenyl)-1H-indole-5-carbonitrile Traditional Name: 3-(4-aminobutyl)-2-(2-methoxy-3-methyl-phenyl)-1H-indole-5-carbonitrile Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C2=C(C3=C(N2)C=CC(=C3)C#N)CCCCN

Isomeric SMILES

CC1=CC=CC(=C1OC)C2=C(C3=C(N2)C=CC(=C3)C#N)CCCCN

InChI

InChI=1S/C21H23N3O/c1-14-6-5-8-17(21(14)25-2)20-16(7-3-4-11-22)18-12-15(13-23)9-10-19(18)24-20/h5-6,8-10,12,24H,3-4,7,11,22H2,1-2H3