[1-[2-[(2-methylpropan-2-yl)oxy]-1,3-bis(oxidanylidene)benzo[de]isoquinolin-6-yl]pyrrolidin-3-yl]carbamic acid

Systemtic Name: [1-[2-[(2-methylpropan-2-yl)oxy]-1,3-bis(oxidanylidene)benzo[de]isoquinolin-6-yl]pyrrolidin-3-yl]carbamic acid Openeye Name: [1-(2-tert-butoxy-1,3-dioxo-benzo[de]isoquinolin-6-yl)pyrrolidin-3-yl]carbamic acid CAS Name: [1-[2-[(2-methylpropan-2-yl)oxy]-1,3-dioxo-6-benzo[de]isoquinolinyl]-3-pyrrolidinyl]carbamic acid IUPAC Name: [1-[2-[(2-methylpropan-2-yl)oxy]-1,3-dioxobenzo[de]isoquinolin-6-yl]pyrrolidin-3-yl]carbamic acid Traditional Name: [1-(2-tert-butoxy-1,3-diketo-benzo[de]isoquinolin-6-yl)pyrrolidin-3-yl]carbamic acid Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ON1C(=O)C2=C3C(=C(C=C2)N4CCC(C4)NC(=O)O)C=CC=C3C1=O

Isomeric SMILES

CC(C)(C)ON1C(=O)C2=C3C(=C(C=C2)N4CCC(C4)NC(=O)O)C=CC=C3C1=O

InChI

InChI=1S/C21H23N3O5/c1-21(2,3)29-24-18(25)14-6-4-5-13-16(8-7-15(17(13)14)19(24)26)23-10-9-12(11-23)22-20(27)28/h4-8,12,22H,9-11H2,1-3H3,(H,27,28)