4-(azepan-1-ylsulfonyl)-N-cyclopentyl-2-nitro-aniline

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-cyclopentyl-2-nitro-aniline Openeye Name: 4-(azepan-1-ylsulfonyl)-N-cyclopentyl-2-nitro-aniline CAS Name: 4-(1-azepanylsulfonyl)-N-cyclopentyl-2-nitroaniline IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-cyclopentyl-2-nitroaniline Traditional Name: [4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-cyclopentyl-amine Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3CCCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4S/c21-20(22)17-13-15(9-10-16(17)18-14-7-3-4-8-14)25(23,24)19-11-5-1-2-6-12-19/h9-10,13-14,18H,1-8,11-12H2