4-azanyl-2-oxidanylidene-1-phenyl-1,6,7,8,9,9a-hexahydrobenzo[7]annulene-3-carbonitrile

Systemtic Name: 4-azanyl-2-oxidanylidene-1-phenyl-1,6,7,8,9,9a-hexahydrobenzo[7]annulene-3-carbonitrile Openeye Name: 4-amino-2-oxo-1-phenyl-1,6,7,8,9,9a-hexahydrobenzo[7]annulene-3-carbonitrile CAS Name: 4-amino-2-oxo-1-phenyl-1,6,7,8,9,9a-hexahydrobenzo[7]annulene-3-carbonitrile IUPAC Name: 4-amino-2-oxo-1-phenyl-1,6,7,8,9,9a-hexahydrobenzo[7]annulene-3-carbonitrile Traditional Name: 4-amino-2-keto-1-phenyl-1,6,7,8,9,9a-hexahydrobenzocycloheptene-3-carbonitrile Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C(=O)C(=C(C2=CC1)N)C#N)C3=CC=CC=C3

Isomeric SMILES

C1CCC2C(C(=O)C(=C(C2=CC1)N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O/c19-11-15-17(20)14-10-6-2-5-9-13(14)16(18(15)21)12-7-3-1-4-8-12/h1,3-4,7-8,10,13,16H,2,5-6,9,20H2