methyl (2Z)-2-[5-(tert-butylamino)-2-oxidanylidene-4-(phenylmethyl)-1H-pyrrol-3-ylidene]ethanoate

Systemtic Name: methyl (2Z)-2-[5-(tert-butylamino)-2-oxidanylidene-4-(phenylmethyl)-1H-pyrrol-3-ylidene]ethanoate Openeye Name: methyl (2Z)-2-[4-benzyl-5-(tert-butylamino)-2-oxo-1H-pyrrol-3-ylidene]acetate CAS Name: (2Z)-2-[5-(tert-butylamino)-2-oxo-4-(phenylmethyl)-1H-pyrrol-3-ylidene]acetic acid methyl ester IUPAC Name: methyl (2Z)-2-[4-benzyl-5-(tert-butylamino)-2-oxo-1H-pyrrol-3-ylidene]acetate Traditional Name: (2Z)-2-[4-benzyl-5-(tert-butylamino)-2-keto-2-pyrrolin-3-ylidene]acetic acid methyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=CC(=O)OC)C(=O)N1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC1=C(/C(=C/C(=O)OC)/C(=O)N1)CC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O3/c1-18(2,3)20-16-13(10-12-8-6-5-7-9-12)14(17(22)19-16)11-15(21)23-4/h5-9,11,20H,10H2,1-4H3,(H,19,22)/b14-11-