2-[(3,6-dibutoxy-4-diazo-cyclohexa-1,5-dien-1-yl)-(phenylmethyl)amino]ethanal

Systemtic Name: 2-[(3,6-dibutoxy-4-diazo-cyclohexa-1,5-dien-1-yl)-(phenylmethyl)amino]ethanal Openeye Name: 2-[benzyl-(3,6-dibutoxy-4-diazo-cyclohexa-1,5-dien-1-yl)amino]acetaldehyde CAS Name: 2-[(3,6-dibutoxy-4-diazo-1-cyclohexa-1,5-dienyl)-(phenylmethyl)amino]acetaldehyde IUPAC Name: 2-[benzyl-(3,6-dibutoxy-4-diazocyclohexa-1,5-dien-1-yl)amino]acetaldehyde Traditional Name: 2-[benzyl-(3,6-dibutoxy-4-diazo-cyclohexa-1,5-dien-1-yl)amino]acetaldehyde Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C=C(C(=CC1=[N+]=[N-])OCCCC)N(CC=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCOC1C=C(C(=CC1=[N+]=[N-])OCCCC)N(CC=O)CC2=CC=CC=C2

InChI

InChI=1S/C23H31N3O3/c1-3-5-14-28-22-17-21(23(16-20(22)25-24)29-15-6-4-2)26(12-13-27)18-19-10-8-7-9-11-19/h7-11,13,16-17,22H,3-6,12,14-15,18H2,1-2H3