O2,O3-diethyl O10-methyl 4-methyl-1-phenylazanyl-benzo[a]azulene-2,3,10-tricarboxylate

Systemtic Name: O2,O3-diethyl O10-methyl 4-methyl-1-phenylazanyl-benzo[a]azulene-2,3,10-tricarboxylate Openeye Name: O2,O3-diethyl O10-methyl 1-anilino-4-methyl-benzo[a]azulene-2,3,10-tricarboxylate CAS Name: 1-anilino-4-methylbenzo[a]azulene-2,3,10-tricarboxylic acid O2,O3-diethyl ester O10-methyl ester IUPAC Name: 2-O,3-O-diethyl 10-O-methyl 1-anilino-4-methylbenzo[a]azulene-2,3,10-tricarboxylate Traditional Name: 1-anilino-4-methyl-benz[a]azulene-2,3,10-tricarboxylic acid O2,O3-diethyl ester O10-methyl ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C3C2=CC=CC=C3)C(=O)OC)C(=C1C(=O)OCC)NC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C3C2=CC=CC=C3)C(=O)OC)C(=C1C(=O)OCC)NC4=CC=CC=C4)C

InChI

InChI=1S/C29H27NO6/c1-5-35-28(32)22-17(3)21-19-15-11-8-12-16-20(19)23(27(31)34-4)24(21)26(25(22)29(33)36-6-2)30-18-13-9-7-10-14-18/h7-16,30H,5-6H2,1-4H3