3-[(cyclopentylamino)methyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[(cyclopentylamino)methyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[(cyclopentylamino)methyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[(cyclopentylamino)methyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[(cyclopentylamino)methyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[(cyclopentylamino)methyl]-4-hydroxy-1,2-naphthoquinone Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NCC2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

C1CCC(C1)NCC2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C16H17NO3/c18-14-11-7-3-4-8-12(11)15(19)16(20)13(14)9-17-10-5-1-2-6-10/h3-4,7-8,10,17-18H,1-2,5-6,9H2