pyren-1-amine

Systemtic Name: pyren-1-amine Openeye Name: pyren-1-amine CAS Name: 1-pyrenamine IUPAC Name: pyren-1-amine Traditional Name: pyren-1-ylamine Formula: C16H11N MolecularWeight: 217.26524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N

InChI

InChI=1S/C16H11N/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H,17H2