N-[(2-methylpropan-2-yl)oxycarbonyl]-N-(3-methylthiophen-2-yl)carbonyl-2-(pyrrol-1-ylamino)ethanamine oxide

Systemtic Name: N-[(2-methylpropan-2-yl)oxycarbonyl]-N-(3-methylthiophen-2-yl)carbonyl-2-(pyrrol-1-ylamino)ethanamine oxide Openeye Name: N-tert-butoxycarbonyl-N-(3-methylthiophene-2-carbonyl)-2-(pyrrol-1-ylamino)ethanamine oxide CAS Name: N-[(2-methylpropan-2-yl)oxy-oxomethyl]-N-[(3-methyl-2-thiophenyl)-oxomethyl]-2-(1-pyrrolylamino)ethanamine oxide IUPAC Name: N-[(2-methylpropan-2-yl)oxycarbonyl]-N-(3-methylthiophene-2-carbonyl)-2-(pyrrol-1-ylamino)ethanamine oxide Traditional Name: N-tert-butoxycarbonyl-N-(3-methylthiophene-2-carbonyl)-2-(pyrrol-1-ylamino)ethanamine oxide Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)[N+](CCNN2C=CC=C2)(C(=O)OC(C)(C)C)[O-]

Isomeric SMILES

CC1=C(SC=C1)C(=O)[N+](CCNN2C=CC=C2)(C(=O)OC(C)(C)C)[O-]

InChI

InChI=1S/C17H23N3O4S/c1-13-7-12-25-14(13)15(21)20(23,16(22)24-17(2,3)4)11-8-18-19-9-5-6-10-19/h5-7,9-10,12,18H,8,11H2,1-4H3