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

Systemtic Name: 2-[(3-iodanylphenyl)amino]-3-pyrrolidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(3-iodoanilino)-3-pyrrolidin-1-yl-naphthalene-1,4-dione CAS Name: 2-(3-iodoanilino)-3-(1-pyrrolidinyl)naphthalene-1,4-dione IUPAC Name: 2-(3-iodoanilino)-3-pyrrolidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(3-iodoanilino)-3-pyrrolidino-1,4-naphthoquinone Formula: C20H17IN2O2 MolecularWeight: 444.26565

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)I

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)I

InChI

InChI=1S/C20H17IN2O2/c21-13-6-5-7-14(12-13)22-17-18(23-10-3-4-11-23)20(25)16-9-2-1-8-15(16)19(17)24/h1-2,5-9,12,22H,3-4,10-11H2