2-(benzo[a]anthracen-5-ylcarbamoylamino)ethanoic acid

Systemtic Name: 2-(benzo[a]anthracen-5-ylcarbamoylamino)ethanoic acid Openeye Name: 2-(benzo[a]anthracen-5-ylcarbamoylamino)acetic acid CAS Name: 2-[[(5-benzo[a]anthracenylamino)-oxomethyl]amino]acetic acid IUPAC Name: 2-(benzo[a]anthracen-5-ylcarbamoylamino)acetic acid Traditional Name: 2-(benz[a]anthracen-5-ylcarbamoylamino)acetic acid Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C4=CC=CC=C4C(=CC3=CC2=C1)NC(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C2C=C3C4=CC=CC=C4C(=CC3=CC2=C1)NC(=O)NCC(=O)O

InChI

InChI=1S/C21H16N2O3/c24-20(25)12-22-21(26)23-19-11-15-9-13-5-1-2-6-14(13)10-18(15)16-7-3-4-8-17(16)19/h1-11H,12H2,(H,24,25)(H2,22,23,26)