4-[3-(4-methylphenoxy)propyl]-7-nitro-1,4-benzoxazin-3-one

Systemtic Name: 4-[3-(4-methylphenoxy)propyl]-7-nitro-1,4-benzoxazin-3-one Openeye Name: 4-[3-(4-methylphenoxy)propyl]-7-nitro-1,4-benzoxazin-3-one CAS Name: 4-[3-(4-methylphenoxy)propyl]-7-nitro-1,4-benzoxazin-3-one IUPAC Name: 4-[3-(4-methylphenoxy)propyl]-7-nitro-1,4-benzoxazin-3-one Traditional Name: 4-[3-(4-methylphenoxy)propyl]-7-nitro-1,4-benzoxazin-3-one Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCN2C(=O)COC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCCN2C(=O)COC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-13-3-6-15(7-4-13)24-10-2-9-19-16-8-5-14(20(22)23)11-17(16)25-12-18(19)21/h3-8,11H,2,9-10,12H2,1H3