4-(cyclopropylcarbonylamino)-2-methoxy-5-nitro-6-nonyl-3-pyrrolidin-3-yl-benzamide

Systemtic Name: 4-(cyclopropylcarbonylamino)-2-methoxy-5-nitro-6-nonyl-3-pyrrolidin-3-yl-benzamide Openeye Name: 4-(cyclopropanecarbonylamino)-2-methoxy-5-nitro-6-nonyl-3-pyrrolidin-3-yl-benzamide CAS Name: 4-[[cyclopropyl(oxo)methyl]amino]-2-methoxy-5-nitro-6-nonyl-3-(3-pyrrolidinyl)benzamide IUPAC Name: 4-(cyclopropanecarbonylamino)-2-methoxy-5-nitro-6-nonyl-3-pyrrolidin-3-ylbenzamide Traditional Name: 4-(cyclopropanecarbonylamino)-2-methoxy-5-nitro-6-nonyl-3-pyrrolidin-3-yl-benzamide Formula: C25H38N4O5 MolecularWeight: 474.59302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C(=C1[N+](=O)[O-])NC(=O)C2CC2)C3CCNC3)OC)C(=O)N

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C(=C1[N+](=O)[O-])NC(=O)C2CC2)C3CCNC3)OC)C(=O)N

InChI

InChI=1S/C25H38N4O5/c1-3-4-5-6-7-8-9-10-18-20(24(26)30)23(34-2)19(17-13-14-27-15-17)21(22(18)29(32)33)28-25(31)16-11-12-16/h16-17,27H,3-15H2,1-2H3,(H2,26,30)(H,28,31)