3-azanyl-2-butyl-4-ethyl-4-phenyl-cyclobut-2-en-1-one

Systemtic Name: 3-azanyl-2-butyl-4-ethyl-4-phenyl-cyclobut-2-en-1-one Openeye Name: 3-amino-2-butyl-4-ethyl-4-phenyl-cyclobut-2-en-1-one CAS Name: 3-amino-2-butyl-4-ethyl-4-phenyl-1-cyclobut-2-enone IUPAC Name: 3-amino-2-butyl-4-ethyl-4-phenylcyclobut-2-en-1-one Traditional Name: 3-amino-2-butyl-4-ethyl-4-phenyl-cyclobut-2-en-1-one Formula: C16H21NO MolecularWeight: 243.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(C1=O)(CC)C2=CC=CC=C2)N

Isomeric SMILES

CCCCC1=C(C(C1=O)(CC)C2=CC=CC=C2)N

InChI

InChI=1S/C16H21NO/c1-3-5-11-13-14(17)16(4-2,15(13)18)12-9-7-6-8-10-12/h6-10H,3-5,11,17H2,1-2H3