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

Systemtic Name: 2-[(3-iodanylphenyl)amino]-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(3-iodoanilino)-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-(3-iodoanilino)-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(3-iodoanilino)-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(3-iodoanilino)-3-piperidino-1,4-naphthoquinone Formula: C21H19IN2O2 MolecularWeight: 458.29223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)I

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)I

InChI

InChI=1S/C21H19IN2O2/c22-14-7-6-8-15(13-14)23-18-19(24-11-4-1-5-12-24)21(26)17-10-3-2-9-16(17)20(18)25/h2-3,6-10,13,23H,1,4-5,11-12H2