4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline

Systemtic Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline Openeye Name: 4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(tetrahydrofuran-2-ylmethyl)aniline CAS Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(2-oxolanylmethyl)aniline IUPAC Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline Traditional Name: [4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]-2-nitro-phenyl]-(tetrahydrofurfuryl)amine Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=C(C=C3)NCC4CCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=C(C=C3)NCC4CCCO4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-13-4-2-5-14(10-13)19-22-20(28-23-19)15-7-8-17(18(11-15)24(25)26)21-12-16-6-3-9-27-16/h2,4-5,7-8,10-11,16,21H,3,6,9,12H2,1H3