N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(Z)-[(2S)-1,2-dimethylbutylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(Z)-[(2S)-1,2-dimethylbutylidene]amino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C16H24N4O4S MolecularWeight: 368.45116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=NNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])C

Isomeric SMILES

CC[C@H](C)/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])/C

InChI

InChI=1S/C16H24N4O4S/c1-4-12(2)13(3)17-18-15-8-7-14(11-16(15)20(21)22)25(23,24)19-9-5-6-10-19/h7-8,11-12,18H,4-6,9-10H2,1-3H3/b17-13-/t12-/m0/s1