cyclopentyl-[(2S)-3-(2-methyl-1-oxidanylidene-3,4-dihydropyrido[3,4-b]indol-9-yl)-2-oxidanyl-propyl]azanium

Systemtic Name: cyclopentyl-[(2S)-3-(2-methyl-1-oxidanylidene-3,4-dihydropyrido[3,4-b]indol-9-yl)-2-oxidanyl-propyl]azanium Openeye Name: cyclopentyl-[(2S)-2-hydroxy-3-(2-methyl-1-oxo-3,4-dihydropyrido[3,4-b]indol-9-yl)propyl]ammonium CAS Name: cyclopentyl-[(2S)-2-hydroxy-3-(2-methyl-1-oxo-3,4-dihydropyrido[3,4-b]indol-9-yl)propyl]ammonium IUPAC Name: cyclopentyl-[(2S)-2-hydroxy-3-(2-methyl-1-oxo-3,4-dihydropyrido[3,4-b]indol-9-yl)propyl]azanium Traditional Name: cyclopentyl-[(2S)-2-hydroxy-3-(1-keto-2-methyl-3,4-dihydro-$b-carbolin-9-yl)propyl]ammonium Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1=O)N(C3=CC=CC=C23)CC(C[NH2+]C4CCCC4)O

Isomeric SMILES

CN1CCC2=C(C1=O)N(C3=CC=CC=C23)C[C@H](C[NH2+]C4CCCC4)O

InChI

InChI=1S/C20H27N3O2/c1-22-11-10-17-16-8-4-5-9-18(16)23(19(17)20(22)25)13-15(24)12-21-14-6-2-3-7-14/h4-5,8-9,14-15,21,24H,2-3,6-7,10-13H2,1H3/p+1/t15-/m0/s1