3-[3-azanyl-1,4-bis(oxidanylidene)naphthalen-2-yl]-2-chloranyl-5-methoxy-naphthalene-1,4-dione

Systemtic Name: 3-[3-azanyl-1,4-bis(oxidanylidene)naphthalen-2-yl]-2-chloranyl-5-methoxy-naphthalene-1,4-dione Openeye Name: 3-(3-amino-1,4-dioxo-2-naphthyl)-2-chloro-5-methoxy-naphthalene-1,4-dione CAS Name: 3-(3-amino-1,4-dioxo-2-naphthalenyl)-2-chloro-5-methoxynaphthalene-1,4-dione IUPAC Name: 3-(3-amino-1,4-dioxonaphthalen-2-yl)-2-chloro-5-methoxynaphthalene-1,4-dione Traditional Name: 3-(3-amino-1,4-diketo-2-naphthyl)-2-chloro-5-methoxy-1,4-naphthoquinone Formula: C21H12ClNO5 MolecularWeight: 393.77668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=O)C(=C(C2=O)Cl)C3=C(C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

COC1=CC=CC2=C1C(=O)C(=C(C2=O)Cl)C3=C(C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C21H12ClNO5/c1-28-12-8-4-7-11-13(12)21(27)14(16(22)19(11)25)15-17(23)20(26)10-6-3-2-5-9(10)18(15)24/h2-8H,23H2,1H3