actinium; methyl 2-chloranyl-4-[(3-hydroxyphenyl)methylcarbamoylamino]benzoate

Systemtic Name: actinium; methyl 2-chloranyl-4-[(3-hydroxyphenyl)methylcarbamoylamino]benzoate Openeye Name: actinium; methyl 2-chloro-4-[(3-hydroxyphenyl)methylcarbamoylamino]benzoate CAS Name: actinium; 2-chloro-4-[[[(3-hydroxyphenyl)methylamino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: actinium; methyl 2-chloro-4-[(3-hydroxyphenyl)methylcarbamoylamino]benzoate Traditional Name: actinium; 2-chloro-4-[(3-hydroxybenzyl)carbamoylamino]benzoic acid methyl ester Formula: C16H15AcClN2O4 MolecularWeight: 561.782047

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)NC(=O)NCC2=CC(=CC=C2)O)Cl.[Ac]

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)NC(=O)NCC2=CC(=CC=C2)O)Cl.[Ac]

InChI

InChI=1S/C16H15ClN2O4.Ac/c1-23-15(21)13-6-5-11(8-14(13)17)19-16(22)18-9-10-3-2-4-12(20)7-10;/h2-8,20H,9H2,1H3,(H2,18,19,22);