3-methoxy-4-[[3-[(4-methoxyphenyl)-(3-phenylpropylamino)methyl]phenyl]amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-methoxy-4-[[3-[(4-methoxyphenyl)-(3-phenylpropylamino)methyl]phenyl]amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-methoxy-4-[3-[(4-methoxyphenyl)-(3-phenylpropylamino)methyl]anilino]cyclobut-3-ene-1,2-dione CAS Name: 3-methoxy-4-[3-[(4-methoxyphenyl)-(3-phenylpropylamino)methyl]anilino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-methoxy-4-[3-[(4-methoxyphenyl)-(3-phenylpropylamino)methyl]anilino]cyclobut-3-ene-1,2-dione Traditional Name: 3-methoxy-4-[3-[(4-methoxyphenyl)-(3-phenylpropylamino)methyl]anilino]cyclobut-3-ene-1,2-quinone Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC(=CC=C2)NC3=C(C(=O)C3=O)OC)NCCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC(=CC=C2)NC3=C(C(=O)C3=O)OC)NCCCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O4/c1-33-23-15-13-20(14-16-23)24(29-17-7-10-19-8-4-3-5-9-19)21-11-6-12-22(18-21)30-25-26(31)27(32)28(25)34-2/h3-6,8-9,11-16,18,24,29-30H,7,10,17H2,1-2H3