(3-chloranyl-6-nitro-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (3-chloranyl-6-nitro-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone Openeye Name: (3-chloro-6-nitro-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone CAS Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone IUPAC Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone Traditional Name: (3-chloro-6-nitro-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone Formula: C15H16ClN3O3S MolecularWeight: 353.82384

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1CCCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H16ClN3O3S/c1-17-5-2-6-18(8-7-17)15(20)14-13(16)11-4-3-10(19(21)22)9-12(11)23-14/h3-4,9H,2,5-8H2,1H3