2-azanyl-1-hexyl-7a-methyl-5-oxidanylidene-indole-3-carbonitrile

Systemtic Name: 2-azanyl-1-hexyl-7a-methyl-5-oxidanylidene-indole-3-carbonitrile Openeye Name: 2-amino-1-hexyl-7a-methyl-5-oxo-indole-3-carbonitrile CAS Name: 2-amino-1-hexyl-7a-methyl-5-oxo-3-indolecarbonitrile IUPAC Name: 2-amino-1-hexyl-7a-methyl-5-oxoindole-3-carbonitrile Traditional Name: 2-amino-1-hexyl-5-keto-7a-methyl-indole-3-carbonitrile Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=CC(=O)C=CC21C)C#N)N

Isomeric SMILES

CCCCCCN1C(=C(C2=CC(=O)C=CC21C)C#N)N

InChI

InChI=1S/C16H21N3O/c1-3-4-5-6-9-19-15(18)13(11-17)14-10-12(20)7-8-16(14,19)2/h7-8,10H,3-6,9,18H2,1-2H3