2-[[8-methoxy-3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]ethyl (2S)-2-acetamido-4-methyl-pentanoate

Systemtic Name: 2-[[8-methoxy-3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]ethyl (2S)-2-acetamido-4-methyl-pentanoate Openeye Name: 2-[(8-methoxy-3-methyl-1,4-dioxo-2-naphthyl)amino]ethyl (2S)-2-acetamido-4-methyl-pentanoate CAS Name: (2S)-2-acetamido-4-methylpentanoic acid 2-[(8-methoxy-3-methyl-1,4-dioxo-2-naphthalenyl)amino]ethyl ester IUPAC Name: 2-[(8-methoxy-3-methyl-1,4-dioxonaphthalen-2-yl)amino]ethyl (2S)-2-acetamido-4-methylpentanoate Traditional Name: (2S)-2-acetamido-4-methyl-valeric acid 2-[(1,4-diketo-8-methoxy-3-methyl-2-naphthyl)amino]ethyl ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1=O)C=CC=C2OC)NCCOC(=O)C(CC(C)C)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)C=CC=C2OC)NCCOC(=O)[C@H](CC(C)C)NC(=O)C

InChI

InChI=1S/C22H28N2O6/c1-12(2)11-16(24-14(4)25)22(28)30-10-9-23-19-13(3)20(26)15-7-6-8-17(29-5)18(15)21(19)27/h6-8,12,16,23H,9-11H2,1-5H3,(H,24,25)/t16-/m0/s1