3-nitro-4-[propan-2-yl(propyl)amino]benzaldehyde

Systemtic Name: 3-nitro-4-[propan-2-yl(propyl)amino]benzaldehyde Openeye Name: 4-[isopropyl(propyl)amino]-3-nitro-benzaldehyde CAS Name: 3-nitro-4-[propan-2-yl(propyl)amino]benzaldehyde IUPAC Name: 3-nitro-4-[propan-2-yl(propyl)amino]benzaldehyde Traditional Name: 4-[isopropyl(propyl)amino]-3-nitro-benzaldehyde Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1)C=O)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCCN(C1=C(C=C(C=C1)C=O)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C13H18N2O3/c1-4-7-14(10(2)3)12-6-5-11(9-16)8-13(12)15(17)18/h5-6,8-10H,4,7H2,1-3H3