methyl 11-methylidene-5-[(3-methylphenyl)methyl]-2-oxidanyl-6-oxidanylidene-benzo[b]carbazole-1-carboxylate

Systemtic Name: methyl 11-methylidene-5-[(3-methylphenyl)methyl]-2-oxidanyl-6-oxidanylidene-benzo[b]carbazole-1-carboxylate Openeye Name: methyl 2-hydroxy-11-methylene-5-(m-tolylmethyl)-6-oxo-benzo[b]carbazole-1-carboxylate CAS Name: 2-hydroxy-11-methylene-5-[(3-methylphenyl)methyl]-6-oxo-1-benzo[b]carbazolecarboxylic acid methyl ester IUPAC Name: methyl 2-hydroxy-11-methylidene-5-[(3-methylphenyl)methyl]-6-oxobenzo[b]carbazole-1-carboxylate Traditional Name: 2-hydroxy-6-keto-5-(3-methylbenzyl)-11-methylene-benzo[b]carbazole-1-carboxylic acid methyl ester Formula: C27H21NO4 MolecularWeight: 423.45994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C3=C(C4=C2C(=O)C5=CC=CC=C5C4=C)C(=C(C=C3)O)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CN2C3=C(C4=C2C(=O)C5=CC=CC=C5C4=C)C(=C(C=C3)O)C(=O)OC

InChI

InChI=1S/C27H21NO4/c1-15-7-6-8-17(13-15)14-28-20-11-12-21(29)24(27(31)32-3)23(20)22-16(2)18-9-4-5-10-19(18)26(30)25(22)28/h4-13,29H,2,14H2,1,3H3