2-[bis(3-methylbutyl)amino]-3-methoxy-naphthalene-1,4-dione

Systemtic Name: 2-[bis(3-methylbutyl)amino]-3-methoxy-naphthalene-1,4-dione Openeye Name: 2-(diisopentylamino)-3-methoxy-naphthalene-1,4-dione CAS Name: 2-[bis(3-methylbutyl)amino]-3-methoxynaphthalene-1,4-dione IUPAC Name: 2-[bis(3-methylbutyl)amino]-3-methoxynaphthalene-1,4-dione Traditional Name: 2-(diisoamylamino)-3-methoxy-1,4-naphthoquinone Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)C1=C(C(=O)C2=CC=CC=C2C1=O)OC

Isomeric SMILES

CC(C)CCN(CCC(C)C)C1=C(C(=O)C2=CC=CC=C2C1=O)OC

InChI

InChI=1S/C21H29NO3/c1-14(2)10-12-22(13-11-15(3)4)18-19(23)16-8-6-7-9-17(16)20(24)21(18)25-5/h6-9,14-15H,10-13H2,1-5H3