diethyl 5,14-dimethyl-1,4,8,11-tetrazacyclotetradeca-5,7,11,13-tetraene-6,13-dicarboxylate

Systemtic Name: diethyl 5,14-dimethyl-1,4,8,11-tetrazacyclotetradeca-5,7,11,13-tetraene-6,13-dicarboxylate Openeye Name: diethyl 5,14-dimethyl-1,4,8,11-tetrazacyclotetradeca-5,7,11,13-tetraene-6,13-dicarboxylate CAS Name: 5,14-dimethyl-1,4,8,11-tetrazacyclotetradeca-5,7,11,13-tetraene-6,13-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5,14-dimethyl-1,4,8,11-tetrazacyclotetradeca-5,7,11,13-tetraene-6,13-dicarboxylate Traditional Name: 5,14-dimethyl-1,4,8,11-tetrazacyclotetradeca-5,7,11,13-tetraene-6,13-dicarboxylic acid diethyl ester Formula: C18H28N4O4 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NCCNC(=C(C=NCCN=C1)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NCCNC(=C(C=NCCN=C1)C(=O)OCC)C)C

InChI

InChI=1S/C18H28N4O4/c1-5-25-17(23)15-11-19-7-8-20-12-16(18(24)26-6-2)14(4)22-10-9-21-13(15)3/h11-12,21-22H,5-10H2,1-4H3