1-[6-(aziridin-1-yl)-3,5-dimethyl-4,7-bis(oxidanylidene)-1H-indol-2-yl]ethyl ethanoate

Systemtic Name: 1-[6-(aziridin-1-yl)-3,5-dimethyl-4,7-bis(oxidanylidene)-1H-indol-2-yl]ethyl ethanoate Openeye Name: 1-[6-(aziridin-1-yl)-3,5-dimethyl-4,7-dioxo-1H-indol-2-yl]ethyl acetate CAS Name: acetic acid 1-[6-(1-aziridinyl)-3,5-dimethyl-4,7-dioxo-1H-indol-2-yl]ethyl ester IUPAC Name: 1-[6-(aziridin-1-yl)-3,5-dimethyl-4,7-dioxo-1H-indol-2-yl]ethyl acetate Traditional Name: acetic acid 1-(6-ethylenimino-4,7-diketo-3,5-dimethyl-1H-indol-2-yl)ethyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=O)C(=C(C2=O)N3CC3)C)C(C)OC(=O)C

Isomeric SMILES

CC1=C(NC2=C1C(=O)C(=C(C2=O)N3CC3)C)C(C)OC(=O)C

InChI

InChI=1S/C16H18N2O4/c1-7-11-13(17-12(7)9(3)22-10(4)19)16(21)14(18-5-6-18)8(2)15(11)20/h9,17H,5-6H2,1-4H3