2-(3-nitrophenyl)-5-(propan-2-ylamino)-3-prop-2-enyl-pyran-4-one

Systemtic Name: 2-(3-nitrophenyl)-5-(propan-2-ylamino)-3-prop-2-enyl-pyran-4-one Openeye Name: 3-allyl-5-(isopropylamino)-2-(3-nitrophenyl)pyran-4-one CAS Name: 2-(3-nitrophenyl)-5-(propan-2-ylamino)-3-prop-2-enyl-4-pyranone IUPAC Name: 2-(3-nitrophenyl)-5-(propan-2-ylamino)-3-prop-2-enylpyran-4-one Traditional Name: 3-allyl-5-(isopropylamino)-2-(3-nitrophenyl)pyran-4-one Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=COC(=C(C1=O)CC=C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=COC(=C(C1=O)CC=C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-4-6-14-16(20)15(18-11(2)3)10-23-17(14)12-7-5-8-13(9-12)19(21)22/h4-5,7-11,18H,1,6H2,2-3H3