[3-[[3,5-bis(methoxycarbonyl)-4-methyl-thiophen-2-yl]carbamoyl]-6-bromanyl-chromen-2-ylidene]azanium

Systemtic Name: [3-[[3,5-bis(methoxycarbonyl)-4-methyl-thiophen-2-yl]carbamoyl]-6-bromanyl-chromen-2-ylidene]azanium Openeye Name: [3-[[3,5-bis(methoxycarbonyl)-4-methyl-2-thienyl]carbamoyl]-6-bromo-chromen-2-ylidene]ammonium CAS Name: [3-[[[3,5-bis(methoxycarbonyl)-4-methyl-2-thiophenyl]amino]-oxomethyl]-6-bromo-1-benzopyran-2-ylidene]ammonium IUPAC Name: [3-[[3,5-bis(methoxycarbonyl)-4-methylthiophen-2-yl]carbamoyl]-6-bromochromen-2-ylidene]azanium Traditional Name: [6-bromo-3-[(3,5-dicarbomethoxy-4-methyl-2-thienyl)carbamoyl]chromen-2-ylidene]ammonium Formula: C19H16BrN2O6S+ MolecularWeight: 480.30914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=[NH2+])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=[NH2+])C(=O)OC

InChI

InChI=1S/C19H15BrN2O6S/c1-8-13(18(24)26-2)17(29-14(8)19(25)27-3)22-16(23)11-7-9-6-10(20)4-5-12(9)28-15(11)21/h4-7,21H,1-3H3,(H,22,23)/p+1