N-[(E)-naphthalen-2-ylmethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(E)-naphthalen-2-ylmethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(E)-2-naphthylmethyleneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(E)-2-naphthalenylmethylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(E)-naphthalen-2-ylmethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(E)-2-naphthylmethyleneamino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4S/c26-25(27)21-14-19(30(28,29)24-11-3-4-12-24)9-10-20(21)23-22-15-16-7-8-17-5-1-2-6-18(17)13-16/h1-2,5-10,13-15,23H,3-4,11-12H2/b22-15+