(4aR,5R,10aS)-N-(4-nitrophenyl)-2,3,4,4a,5,10a-hexahydropyrano[2,3-b]chromen-5-amine

Systemtic Name: (4aR,5R,10aS)-N-(4-nitrophenyl)-2,3,4,4a,5,10a-hexahydropyrano[2,3-b]chromen-5-amine Openeye Name: (4aR,5R,10aS)-N-(4-nitrophenyl)-2,3,4,4a,5,10a-hexahydropyrano[2,3-b]chromen-5-amine CAS Name: (4aR,5R,10aS)-N-(4-nitrophenyl)-2,3,4,4a,5,10a-hexahydropyrano[2,3-b][1]benzopyran-5-amine IUPAC Name: (4aR,5R,10aS)-N-(4-nitrophenyl)-2,3,4,4a,5,10a-hexahydropyrano[2,3-b]chromen-5-amine Traditional Name: [(4aR,5R,10aS)-2,3,4,4a,5,10a-hexahydropyrano[2,3-b]chromen-5-yl]-(4-nitrophenyl)amine Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C3=CC=CC=C3OC2OC1)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H]2[C@H](C3=CC=CC=C3O[C@@H]2OC1)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O4/c21-20(22)13-9-7-12(8-10-13)19-17-14-4-1-2-6-16(14)24-18-15(17)5-3-11-23-18/h1-2,4,6-10,15,17-19H,3,5,11H2/t15-,17+,18+/m1/s1