(4R)-2-azanyl-7-methoxy-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-chromene-3-carbonitrile

Systemtic Name: (4R)-2-azanyl-7-methoxy-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-chromene-3-carbonitrile Openeye Name: (4R)-2-amino-7-methoxy-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-chromene-3-carbonitrile CAS Name: (4R)-2-amino-7-methoxy-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-2-amino-7-methoxy-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-chromene-3-carbonitrile Traditional Name: (4R)-2-amino-7-methoxy-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-chromene-3-carbonitrile Formula: C18H13N3O6 MolecularWeight: 367.31232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(C(=C(O2)N)C#N)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

COC1=CC2=C(C=C1)[C@H](C(=C(O2)N)C#N)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H13N3O6/c1-24-9-2-3-10-14(4-9)27-18(20)12(7-19)17(10)11-5-15-16(26-8-25-15)6-13(11)21(22)23/h2-6,17H,8,20H2,1H3/t17-/m0/s1