2-[3-[2-[3-[(2-oxidanidyl-5-propan-2-yl-phenyl)methylideneamino]propylamino]ethylamino]propyliminomethyl]-4-propan-2-yl-phenolate

Systemtic Name: 2-[3-[2-[3-[(2-oxidanidyl-5-propan-2-yl-phenyl)methylideneamino]propylamino]ethylamino]propyliminomethyl]-4-propan-2-yl-phenolate Openeye Name: 4-isopropyl-2-[3-[2-[3-[(5-isopropyl-2-oxido-phenyl)methyleneamino]propylamino]ethylamino]propyliminomethyl]phenolate CAS Name: 2-[3-[2-[3-[(2-oxido-5-propan-2-ylphenyl)methylideneamino]propylamino]ethylamino]propyliminomethyl]-4-propan-2-ylphenolate IUPAC Name: 2-[3-[2-[3-[(2-oxido-5-propan-2-ylphenyl)methylideneamino]propylamino]ethylamino]propyliminomethyl]-4-propan-2-ylphenolate Traditional Name: 4-isopropyl-2-[3-[2-[3-[(5-isopropyl-2-oxido-benzylidene)amino]propylamino]ethylamino]propyliminomethyl]phenolate Formula: C28H40N4O2-2 MolecularWeight: 464.6428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)[O-])C=NCCCNCCNCCCN=CC2=C(C=CC(=C2)C(C)C)[O-]

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)[O-])C=NCCCNCCNCCCN=CC2=C(C=CC(=C2)C(C)C)[O-]

InChI

InChI=1S/C28H42N4O2/c1-21(2)23-7-9-27(33)25(17-23)19-31-13-5-11-29-15-16-30-12-6-14-32-20-26-18-24(22(3)4)8-10-28(26)34/h7-10,17-22,29-30,33-34H,5-6,11-16H2,1-4H3/p-2