2-chloranyl-3-(hexadecylamino)naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-(hexadecylamino)naphthalene-1,4-dione Openeye Name: 2-chloro-3-(hexadecylamino)naphthalene-1,4-dione CAS Name: 2-chloro-3-(hexadecylamino)naphthalene-1,4-dione IUPAC Name: 2-chloro-3-(hexadecylamino)naphthalene-1,4-dione Traditional Name: 2-(cetylamino)-3-chloro-1,4-naphthoquinone Formula: C26H38ClNO2 MolecularWeight: 432.03842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C26H38ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-28-24-23(27)25(29)21-18-15-16-19-22(21)26(24)30/h15-16,18-19,28H,2-14,17,20H2,1H3