1-[9-(phenylmethyl)pyrido[3,4-b]indol-3-yl]oxypropan-2-one

Systemtic Name: 1-[9-(phenylmethyl)pyrido[3,4-b]indol-3-yl]oxypropan-2-one Openeye Name: 1-(9-benzylpyrido[3,4-b]indol-3-yl)oxypropan-2-one CAS Name: 1-[[9-(phenylmethyl)-3-pyrido[3,4-b]indolyl]oxy]-2-propanone IUPAC Name: 1-(9-benzylpyrido[3,4-b]indol-3-yl)oxypropan-2-one Traditional Name: 1-[(9-benzyl-$b-carbolin-3-yl)oxy]acetone Formula: C21H18N2O2 MolecularWeight: 330.37982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=NC=C2C(=C1)C3=CC=CC=C3N2CC4=CC=CC=C4

Isomeric SMILES

CC(=O)COC1=NC=C2C(=C1)C3=CC=CC=C3N2CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O2/c1-15(24)14-25-21-11-18-17-9-5-6-10-19(17)23(20(18)12-22-21)13-16-7-3-2-4-8-16/h2-12H,13-14H2,1H3