2,2-bis(2-cyclopropylethyl)-5-[1-(3-nitrophenyl)propyl]-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 2,2-bis(2-cyclopropylethyl)-5-[1-(3-nitrophenyl)propyl]-6-oxidanyl-3H-pyran-4-one Openeye Name: 2,2-bis(2-cyclopropylethyl)-6-hydroxy-5-[1-(3-nitrophenyl)propyl]-3H-pyran-4-one CAS Name: 2,2-bis(2-cyclopropylethyl)-6-hydroxy-5-[1-(3-nitrophenyl)propyl]-3H-pyran-4-one IUPAC Name: 2,2-bis(2-cyclopropylethyl)-6-hydroxy-5-[1-(3-nitrophenyl)propyl]-3H-pyran-4-one Traditional Name: 2,2-bis(2-cyclopropylethyl)-6-hydroxy-5-[1-(3-nitrophenyl)propyl]-3H-pyran-4-one Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)[N+](=O)[O-])C2=C(OC(CC2=O)(CCC3CC3)CCC4CC4)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)[N+](=O)[O-])C2=C(OC(CC2=O)(CCC3CC3)CCC4CC4)O

InChI

InChI=1S/C24H31NO5/c1-2-20(18-4-3-5-19(14-18)25(28)29)22-21(26)15-24(30-23(22)27,12-10-16-6-7-16)13-11-17-8-9-17/h3-5,14,16-17,20,27H,2,6-13,15H2,1H3