4-(4-methoxy-3-nitro-phenyl)sulfonyl-N-(3-propan-2-yloxypropyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-methoxy-3-nitro-phenyl)sulfonyl-N-(3-propan-2-yloxypropyl)piperazine-1-carboxamide Openeye Name: N-(3-isopropoxypropyl)-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine-1-carboxamide CAS Name: 4-(4-methoxy-3-nitrophenyl)sulfonyl-N-(3-propan-2-yloxypropyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-methoxy-3-nitrophenyl)sulfonyl-N-(3-propan-2-yloxypropyl)piperazine-1-carboxamide Traditional Name: N-(3-isopropoxypropyl)-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine-1-carboxamide Formula: C18H28N4O7S MolecularWeight: 444.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCCCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H28N4O7S/c1-14(2)29-12-4-7-19-18(23)20-8-10-21(11-9-20)30(26,27)15-5-6-17(28-3)16(13-15)22(24)25/h5-6,13-14H,4,7-12H2,1-3H3,(H,19,23)