(1-chloranyl-4-methyl-5H-pyrido[4,3-b]indol-8-yl) 2,6-dimethylbenzoate

Systemtic Name: (1-chloranyl-4-methyl-5H-pyrido[4,3-b]indol-8-yl) 2,6-dimethylbenzoate Openeye Name: (1-chloro-4-methyl-5H-pyrido[4,3-b]indol-8-yl) 2,6-dimethylbenzoate CAS Name: 2,6-dimethylbenzoic acid (1-chloro-4-methyl-5H-pyrido[4,3-b]indol-8-yl) ester IUPAC Name: (1-chloro-4-methyl-5H-pyrido[4,3-b]indol-8-yl) 2,6-dimethylbenzoate Traditional Name: 2,6-dimethylbenzoic acid (1-chloro-4-methyl-5H-pyrid[4,3-b]indol-8-yl) ester Formula: C21H17ClN2O2 MolecularWeight: 364.82488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)OC2=CC3=C(C=C2)NC4=C3C(=NC=C4C)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)OC2=CC3=C(C=C2)NC4=C3C(=NC=C4C)Cl

InChI

InChI=1S/C21H17ClN2O2/c1-11-5-4-6-12(2)17(11)21(25)26-14-7-8-16-15(9-14)18-19(24-16)13(3)10-23-20(18)22/h4-10,24H,1-3H3