1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)hexadecan-1-one

Systemtic Name: 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)hexadecan-1-one Openeye Name: 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)hexadecan-1-one CAS Name: 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-1-hexadecanone IUPAC Name: 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)hexadecan-1-one Traditional Name: 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrid[4,3-b]indol-5-yl)hexadecan-1-one Formula: C29H48N2O MolecularWeight: 440.70422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N1C2CCN(CC2C3=C1C=CC(=C3)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N1C2CCN(CC2C3=C1C=CC(=C3)C)C

InChI

InChI=1S/C29H48N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-29(32)31-27-19-18-24(2)22-25(27)26-23-30(3)21-20-28(26)31/h18-19,22,26,28H,4-17,20-21,23H2,1-3H3