2-[(4-octoxyphenyl)amino]-3-pyrrolidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-[(4-octoxyphenyl)amino]-3-pyrrolidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(4-octoxyanilino)-3-pyrrolidin-1-yl-naphthalene-1,4-dione CAS Name: 2-(4-octoxyanilino)-3-(1-pyrrolidinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-octoxyanilino)-3-pyrrolidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(4-octoxyanilino)-3-pyrrolidino-1,4-naphthoquinone Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCC4

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCC4

InChI

InChI=1S/C28H34N2O3/c1-2-3-4-5-6-11-20-33-22-16-14-21(15-17-22)29-25-26(30-18-9-10-19-30)28(32)24-13-8-7-12-23(24)27(25)31/h7-8,12-17,29H,2-6,9-11,18-20H2,1H3