methyl 3-[(3-methoxycarbonylazulen-1-yl)-phenyl-methyl]azulene-1-carboxylate

Systemtic Name: methyl 3-[(3-methoxycarbonylazulen-1-yl)-phenyl-methyl]azulene-1-carboxylate Openeye Name: methyl 3-[(3-methoxycarbonylazulen-1-yl)-phenyl-methyl]azulene-1-carboxylate CAS Name: 3-[(3-methoxycarbonyl-1-azulenyl)-phenylmethyl]-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-methoxycarbonylazulen-1-yl)-phenylmethyl]azulene-1-carboxylate Traditional Name: 3-[(3-carbomethoxyazulen-1-yl)-phenyl-methyl]azulene-1-carboxylic acid methyl ester Formula: C31H24O4 MolecularWeight: 460.51986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C1=CC=CC=C2)C(C3=CC=CC=C3)C4=C5C=CC=CC=C5C(=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=C2C1=CC=CC=C2)C(C3=CC=CC=C3)C4=C5C=CC=CC=C5C(=C4)C(=O)OC

InChI

InChI=1S/C31H24O4/c1-34-30(32)27-18-25(21-14-8-4-10-16-23(21)27)29(20-12-6-3-7-13-20)26-19-28(31(33)35-2)24-17-11-5-9-15-22(24)26/h3-19,29H,1-2H3