ethyl 4-(1,4-diazepan-1-ylsulfonyl)benzoate

Systemtic Name: ethyl 4-(1,4-diazepan-1-ylsulfonyl)benzoate Openeye Name: ethyl 4-(1,4-diazepan-1-ylsulfonyl)benzoate CAS Name: 4-(1,4-diazepan-1-ylsulfonyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(1,4-diazepan-1-ylsulfonyl)benzoate Traditional Name: 4-(1,4-diazepan-1-ylsulfonyl)benzoic acid ethyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCNCC2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCNCC2

InChI

InChI=1S/C14H20N2O4S/c1-2-20-14(17)12-4-6-13(7-5-12)21(18,19)16-10-3-8-15-9-11-16/h4-7,15H,2-3,8-11H2,1H3