1-[1-(1-azanylethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]dodecan-1-one

Systemtic Name: 1-[1-(1-azanylethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]dodecan-1-one Openeye Name: 1-[1-(1-aminoethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]dodecan-1-one CAS Name: 1-[1-(1-aminoethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-1-dodecanone IUPAC Name: 1-[1-(1-aminoethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]dodecan-1-one Traditional Name: 1-[1-(1-aminoethyl)-1,3,4,9-tetrahydro-$b-carbolin-2-yl]dodecan-1-one Formula: C25H39N3O MolecularWeight: 397.59666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1CCC2=C(C1C(C)N)NC3=CC=CC=C23

Isomeric SMILES

CCCCCCCCCCCC(=O)N1CCC2=C(C1C(C)N)NC3=CC=CC=C23

InChI

InChI=1S/C25H39N3O/c1-3-4-5-6-7-8-9-10-11-16-23(29)28-18-17-21-20-14-12-13-15-22(20)27-24(21)25(28)19(2)26/h12-15,19,25,27H,3-11,16-18,26H2,1-2H3