2-azanyl-3-[(2S,3R)-2-ethyl-3-phenyl-aziridin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-azanyl-3-[(2S,3R)-2-ethyl-3-phenyl-aziridin-1-yl]naphthalene-1,4-dione Openeye Name: 2-amino-3-[(2S,3R)-2-ethyl-3-phenyl-aziridin-1-yl]naphthalene-1,4-dione CAS Name: 2-amino-3-[(2S,3R)-2-ethyl-3-phenyl-1-aziridinyl]naphthalene-1,4-dione IUPAC Name: 2-amino-3-[(2S,3R)-2-ethyl-3-phenylaziridin-1-yl]naphthalene-1,4-dione Traditional Name: 2-amino-3-[(2S,3R)-2-ethyl-3-phenyl-ethylenimin-1-yl]-1,4-naphthoquinone Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(N1C2=C(C(=O)C3=CC=CC=C3C2=O)N)C4=CC=CC=C4

Isomeric SMILES

CC[C@H]1[C@H](N1C2=C(C(=O)C3=CC=CC=C3C2=O)N)C4=CC=CC=C4

InChI

InChI=1S/C20H18N2O2/c1-2-15-17(12-8-4-3-5-9-12)22(15)18-16(21)19(23)13-10-6-7-11-14(13)20(18)24/h3-11,15,17H,2,21H2,1H3/t15-,17+,22?/m0/s1