ethyl 3-[4-(6-methoxy-6-oxidanylidene-hexanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[4-(6-methoxy-6-oxidanylidene-hexanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-(6-methoxy-6-oxo-hexanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate CAS Name: 3-[4-(6-methoxy-1,6-dioxohexyl)-1,4-diazepan-1-yl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(6-methoxy-6-oxohexanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate Traditional Name: 3-[4-(6-keto-6-methoxy-hexanoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylic acid ethyl ester Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCCN(CC3)C(=O)CCCCC(=O)OC

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCCN(CC3)C(=O)CCCCC(=O)OC

InChI

InChI=1S/C23H30N4O5/c1-3-32-23(30)21-22(25-18-10-5-4-9-17(18)24-21)27-14-8-13-26(15-16-27)19(28)11-6-7-12-20(29)31-2/h4-5,9-10H,3,6-8,11-16H2,1-2H3