N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-1-propyl-piperidin-4-amine

Systemtic Name: N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-1-propyl-piperidin-4-amine Openeye Name: N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-1-propyl-piperidin-4-amine CAS Name: N-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-1-propyl-4-piperidinamine IUPAC Name: N-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)-1-propylpiperidin-4-amine Traditional Name: (2-nitro-4-pyrrolidinosulfonyl-phenyl)-(1-propyl-4-piperidyl)amine Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCCN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H28N4O4S/c1-2-9-20-12-7-15(8-13-20)19-17-6-5-16(14-18(17)22(23)24)27(25,26)21-10-3-4-11-21/h5-6,14-15,19H,2-4,7-13H2,1H3