8-[(4-chloranyl-3-methyl-phenyl)amino]-5-methyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indole-6-carbonitrile

Systemtic Name: 8-[(4-chloranyl-3-methyl-phenyl)amino]-5-methyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indole-6-carbonitrile Openeye Name: 8-(4-chloro-3-methyl-anilino)-5-methyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indole-6-carbonitrile CAS Name: 8-(4-chloro-3-methylanilino)-5-methyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indole-6-carbonitrile IUPAC Name: 8-(4-chloro-3-methylanilino)-5-methyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indole-6-carbonitrile Traditional Name: 8-(4-chloro-3-methyl-anilino)-5-methyl-1,2,3,4,4a,9b-hexahydropyrid[4,3-b]indole-6-carbonitrile Formula: C20H21ClN4 MolecularWeight: 352.86054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=CC3=C(C(=C2)C#N)N(C4C3CNCC4)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=CC3=C(C(=C2)C#N)N(C4C3CNCC4)C)Cl

InChI

InChI=1S/C20H21ClN4/c1-12-7-14(3-4-18(12)21)24-15-8-13(10-22)20-16(9-15)17-11-23-6-5-19(17)25(20)2/h3-4,7-9,17,19,23-24H,5-6,11H2,1-2H3