1-(4-butoxyphenyl)-6-chloranyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Systemtic Name: 1-(4-butoxyphenyl)-6-chloranyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Openeye Name: 1-(4-butoxyphenyl)-6-chloro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole CAS Name: 1-(4-butoxyphenyl)-6-chloro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole IUPAC Name: 1-(4-butoxyphenyl)-6-chloro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Traditional Name: 1-(4-butoxyphenyl)-6-chloro-2,3,4,9-tetrahydro-1H-$b-carboline Formula: C21H23ClN2O MolecularWeight: 354.87312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C21H23ClN2O/c1-2-3-12-25-16-7-4-14(5-8-16)20-21-17(10-11-23-20)18-13-15(22)6-9-19(18)24-21/h4-9,13,20,23-24H,2-3,10-12H2,1H3