2-butyl-9-(2-hydroxyethyl)-6-nitro-3,4-dihydropyrido[3,4-b]indol-1-one

Systemtic Name: 2-butyl-9-(2-hydroxyethyl)-6-nitro-3,4-dihydropyrido[3,4-b]indol-1-one Openeye Name: 2-butyl-9-(2-hydroxyethyl)-6-nitro-3,4-dihydropyrido[3,4-b]indol-1-one CAS Name: 2-butyl-9-(2-hydroxyethyl)-6-nitro-3,4-dihydropyrido[3,4-b]indol-1-one IUPAC Name: 2-butyl-9-(2-hydroxyethyl)-6-nitro-3,4-dihydropyrido[3,4-b]indol-1-one Traditional Name: 2-butyl-9-(2-hydroxyethyl)-6-nitro-3,4-dihydro-$b-carbolin-1-one Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=C(C1=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])CCO

Isomeric SMILES

CCCCN1CCC2=C(C1=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])CCO

InChI

InChI=1S/C17H21N3O4/c1-2-3-7-18-8-6-13-14-11-12(20(23)24)4-5-15(14)19(9-10-21)16(13)17(18)22/h4-5,11,21H,2-3,6-10H2,1H3