1-chloranyl-5-(1,4-diazepan-1-ylsulfonyl)-8-methoxy-isoquinoline

Systemtic Name: 1-chloranyl-5-(1,4-diazepan-1-ylsulfonyl)-8-methoxy-isoquinoline Openeye Name: 1-chloro-5-(1,4-diazepan-1-ylsulfonyl)-8-methoxy-isoquinoline CAS Name: 1-chloro-5-(1,4-diazepan-1-ylsulfonyl)-8-methoxyisoquinoline IUPAC Name: 1-chloro-5-(1,4-diazepan-1-ylsulfonyl)-8-methoxyisoquinoline Traditional Name: 1-chloro-5-(1,4-diazepan-1-ylsulfonyl)-8-methoxy-isoquinoline Formula: C15H18ClN3O3S MolecularWeight: 355.83972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)S(=O)(=O)N3CCCNCC3)C=CN=C2Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)S(=O)(=O)N3CCCNCC3)C=CN=C2Cl

InChI

InChI=1S/C15H18ClN3O3S/c1-22-12-3-4-13(11-5-7-18-15(16)14(11)12)23(20,21)19-9-2-6-17-8-10-19/h3-5,7,17H,2,6,8-10H2,1H3