diethyl 2-azanyl-6-oct-1-ynyl-azulene-1,3-dicarboxylate

Systemtic Name: diethyl 2-azanyl-6-oct-1-ynyl-azulene-1,3-dicarboxylate Openeye Name: diethyl 2-amino-6-oct-1-ynyl-azulene-1,3-dicarboxylate CAS Name: 2-amino-6-oct-1-ynylazulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-6-oct-1-ynylazulene-1,3-dicarboxylate Traditional Name: 2-amino-6-oct-1-ynyl-azulene-1,3-dicarboxylic acid diethyl ester Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=C2C(=C(C(=C2C(=O)OCC)N)C(=O)OCC)C=C1

Isomeric SMILES

CCCCCCC#CC1=CC=C2C(=C(C(=C2C(=O)OCC)N)C(=O)OCC)C=C1

InChI

InChI=1S/C24H29NO4/c1-4-7-8-9-10-11-12-17-13-15-18-19(16-14-17)21(24(27)29-6-3)22(25)20(18)23(26)28-5-2/h13-16H,4-10,25H2,1-3H3